Compound - Results

Nitrofural

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Information Structure
Name Nitrofural
Synonyms
(5-Nitro-2-furfurylidenamino)urea
1-(5-Nitro-2-furfurylidene)semicarbazide
2((5-Nitro-2-furanyl)methylene)hydrazinecarboxamide
2-Furaldehyde, 5-nitro-, Semicarbazone
2-Furancarboxaldehyde, 5-nitro-, Semicarbazone
5-17-09-00335 (Beilstein Handbook Reference)
5-Nitro-2-furaldehyde Semicarbazone
5-Nitro-2-furancarboxaldehyde Semicarbazone
5-Nitro-2-furfural Semicarbazone
5-Nitro-2-furfuraldehyde Semicarbazone
5-Nitrofuraldehyde Semicarbazide
5-Nitrofuran-2-aldehyde Semicarbazone
5-Nitrofurazone
5-Nitrofurfural Semicarbazone
6-Nitrofuraldehyde Semicarbazide
Actin-N
Acutol
AI3-17333
Aldomycin
Alfucin
Amifur
Babrocid
Becafurazone
Biofuracina
Biofurea
BRN 0086403
CCRIS 1195
Chemofuran
Chixin
Cocafurin
Coxistat
Dermofural
Dynazone
EINECS 200-443-1
Eldezol
Eldezol F-6
Fedacin
Flavazone
Fracine
Furacilin
Furacilinum
Furacillin
Furacin
Furacin-E
Furacin-HC
Furacine
Furacinetten
Furacoccid
Furacort
Furacycline
Furaderm
Furagent
Furaldon
Furalone
Furametral
Furan-ofteno
Furaplast
Furaseptyl
Furaskin
Furatsilin
Furaziline
Furazin
Furazina
Furazol W
Furazone
Furazyme
Furesol
Furfurin
Furosem
Fuvacillin
Hemofuran
HSDB 3136
Hydrazinecarboxamide, 2-((5-nitro-2-furanyl)methylene)-
Ibiofural
Mammex
Mastofuran
Monafuracin
Monafuracis
Monofuracin
NCI-C56064
Nefco
NF-7
NFS
NFZ
Nifucin
Nifurid
Nifuzon
Nitrofural
Nitrofuraldehyde Semicarbazone
Nitrofuralum
Nitrofuran
Nitrofuran (bactericide)
Nitrofurane
Nitrofurazan
Nitrofurazone
Nitrofurazonum
Nitrofurol
Nitrozone
NSC 1602
NSC-2100
Otofural
Otofuran
Rivafurazon
Rivopon-5
Sanfuran
Semikarbazon 5-nitrofurfuralu
Spray-dermis
Spray-foral
U-6421
USAF EA-4
Vabrocid
Vadrocid
Veterinary Nitrofurazone
Yatrocin
ATC B05CA03
D08AF01
D09AA03
P01CC02
S01AX04
S02AA02
CID 1839
CAS 000059870
Drugbank ID DB00336
SMILES NC(=O)NN=CC1=CC=C(O1)[N+]([O-])=O
Formula C6H6N4O4
Molweight 198.136
Atoms 15
LogP 1.8044
Rotatable Bonds 4
H-Bond Donors 0
H-Bond Acceptors 7
CYP interactions
NameRelationsReferences
2D6Substrate 10939229
Bibrocathol

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Information Structure
Name Bibrocathol
Synonyms
Bibrocathol
Bibrocatholum
EINECS 230-023-3
ATC S01AX05
CID 16683103
CAS 006915577
SMILES O[Bi]1OC2=C(O1)C(Br)=C(Br)C(Br)=C2Br
Resorcinol

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Information Structure
Name Resorcinol
Synonyms
1,3-Benzenediol
1,3-Dihydroxybenzene
3-Hydroxycyclohexadien-1-one
3-Hydroxyphenol
4-06-00-05658 (Beilstein Handbook Reference)
AI3-03996
Benzene, 1,3-dihydroxy-
Benzene, M-dihydroxy-
BRN 0906905
C.I. 76505
C.I. Developer 4
C.I. Oxidation Base 31
Caswell No. 723
CCRIS 4052
Developer O
Developer R
Developer RS
Dihydroxybenzol
Durafur Developer G
EINECS 203-585-2
EPA Pesticide Chemical Code 071401
FEMA No. 3589
Fouramine RS
Fourrine 79
Fourrine EW
HSDB 722
m-Benzenediol
m-Dihydroxybenzene
m-Dioxybenzene
m-Hydroquinone
m-Hydroxyphenol
Nako TGG
NCI-C05970
NSC 1571
Pelagol Grey RS
Pelagol RS
Phenol, M-hydroxy-
RCRA Waste Number U201
Resorcin
Resorcine
Resorcinol
Resorcinolum
Resorzin
ATC D10AX02
S01AX06
CID 5054
CAS 000108463
SMILES OC1=CC=CC(O)=C1
Formula C6H6O2
Molweight 110.111
Atoms 8
LogP 1.0978
Rotatable Bonds 0
H-Bond Donors 0
H-Bond Acceptors 2
Sodium Borate

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Information Structure
Name Sodium borate
Synonyms
Boric Acid (HBO2), Sodium Salt
Borosoap
Caswell No. 779AA
EINECS 231-891-6
EPA Pesticide Chemical Code 011104
HSDB 5045
Kodalk
Sodium Borate
Sodium Borate (NaBO2)
Sodium Metaborate
ATC S01AX07
CID 145326
CAS 007775191
Herbal origin Prepared pollen of longbract cattail
SMILES [O-]B=O
Hexamidine

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Information Structure
Name Hexamidine
Synonyms
4,4-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide
Hexamidina
Hexamidine
Hexamidinum
ATC D08AC04
R01AX07
R02AA18
S01AX08
S03AA05
CID 65130
CAS 003811754
SMILES NC(=N)C1=CC=C(OCCCCCCOC2=CC=C(C=C2)C(N)=N)C=C1
Formula C20H26N4O2
Molweight 354.446
Atoms 26
LogP 4.873
Rotatable Bonds 11
H-Bond Donors 0
H-Bond Acceptors 6
Chlorhexidine

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Information Structure
Name Chlorhexidine
Synonyms
1,1-Hexamethylenebis(5-(p-chlorophenyl)biguanide)
1,6-Bis(5-(p-chlorophenyl)biguandino)hexane
1,6-Bis(p-chlorophenyldiguanido)hexane
1,6-Di(4-chlorophenyldiguanido)hexane
2,4,11,13-Tetraazatetradecanediimidamide, N,N-bis(4-chlorophenyl)-3,12-diimino-
4-12-00-01201 (Beilstein Handbook Reference)
BRN 2826432
Chlorhexidin
Chlorhexidine
Chlorhexidinum
Cloresidina
Clorhexidina
EINECS 200-238-7
Fimeil
Hexadol
Nolvasan
Rotersept
Soretol
Sterilon
Tubulicid
ATC A01AB03
B05CA02
D08AC02
D09AA12
G04BX14
R02AA05
S01AX09
S02AA09
S03AA04
CID 9552079
CAS 000055561
TTD Drug ID DAP001326
SMILES ClC1=CC=C(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NC2=CC=C(Cl)C=C2)C=C1
Formula C22H30Cl2N10
Molweight 505.447
Atoms 34
LogP 6.2838
Rotatable Bonds 13
H-Bond Donors 6
H-Bond Acceptors 10
Phase2 interactions
NameReferences
MET 3337739
Sodium Propionate

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Information Structure
Name Sodium propionate
Synonyms
Bioban-S
Caswell No. 707A
CCRIS 1896
Deketon
EINECS 205-290-4
EPA Pesticide Chemical Code 077703
HSDB 766
Impedex
Keenate
Mycoban
Napropion
Natriumpropionat
Ocuseptine
Propanoic Acid, Sodium Salt
Propi-ophtal
Propiofar
Propion
Propionan Sodny
Propionic Acid Sodium Salt
Propisol
Sodium Propanoate
Sodium Propionate
Sodium Propionate Anhydrous
Whit-pro
ATC S01AX10
CID 2723816
CAS 000137406
SMILES CCC([O-])=O
Formula C3H5NaO2
Molweight 96.0604
Atoms 6
LogP -0.8537
Rotatable Bonds 1
H-Bond Donors 0
H-Bond Acceptors 2
Ofloxacin

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Information Structure
Name Ofloxacin
Synonyms
( -)-9-Fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl)-7-oxo-7H-pyrido(1,2,3-de)(1,4)benzoxazin-6-carbonsaeure
(+-)-9-Fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl)-7-oxo-7H-pyrido(1,2,3-de)-1,4-benzoxazine-6-carboxylic Acid
BRN 3657947
CCRIS 5233
DL 8280
DL-8280
Floxin
HOE 280
Ocuflox
Oflocet
Ofloxacin
Ofloxacina
Ofloxacine
Ofloxacino
Ofloxacinum
ORF 18489
Oxaldin
PT 01
Tarivid
Visiren
ATC J01MA01
S01AX11
S02AA16
CID 4583
CAS 082419361
Drugbank ID DB01165
TTD Drug ID DAP000655
SMILES C[C@H]1COC2=C3N1C=C(C(O)=O)C(=O)C3=CC(F)=C2N4CCN(C)CC4
Formula C18H20FN3O4
Molweight 361.367
Atoms 26
LogP 1.5469
Rotatable Bonds 2
H-Bond Donors 0
H-Bond Acceptors 6
CYP interactions
NameRelationsReferences
1A2Inhibitor 1510417
Extrarenal fraction 0.1
Elimination half-life 6h
Norfloxacin

Java required.


Information Structure
Name Norfloxacin
Synonyms
1,4-Dihydro-1-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic Acid
1-Ethyl-6-fluor-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-chinolincarbonsaeure
1-Ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic Acid
5-23-03-00135 (Beilstein Handbook Reference)
AM 715
AM-715
Baccidal
Barazan
BRN 0567897
CCRIS 6302
Chibroxin
EINECS 274-614-4
Fulgram
MK 0366
MK-366
Norfloxacin
Norfloxacine
Norfloxacino
Norfloxacinum
Noroxin
Sebercim
ATC J01MA06
S01AX12
CID 4539
CAS 070458967
Drugbank ID DB01059
TTD Drug ID DAP000654
SMILES CCN1C=C(C(O)=O)C(=O)C2=C1C=C(N3CCNCC3)C(F)=C2
Formula C16H18FN3O3
Molweight 319.331
Atoms 23
LogP 1.6621
Rotatable Bonds 3
H-Bond Donors 0
H-Bond Acceptors 5
CYP interactions
NameRelationsReferences
1A1Inhibitor 8894516
1A2Inhibitor 11735605
10096258
8894516
11735605
1510417
2A6Inhibitor 14738594
3A4Inhibitor 8894516
8894516
7554706
3A5Inhibitor 8894516
3A7Inhibitor 8894516
Transporter
AC-No.NameReferences
Q9UNQ0ATP-binding cassette sub-family G member 216434544
Extrarenal fraction 0.7
Elimination half-life 4.8h
Ciprofloxacin

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Information Structure
Name Ciprofloxacin
Synonyms
1-Cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic Acid
1-Cyclopropyl-6-fluoro-4-oxo-7-(1-piperazinyl)-1,4-dihydro-3-quinolinecarboxylic Acid
Alcon Cilox
Bacquinor
Baflox
BAY Q 3939
Bernoflox
Bi-Cipro
BRN 3568352
CCRIS 5241
Cifloxin
Cilab
Ciplus
Ciprecu
Cipro
Cipro IV
Cipro XR
Ciprobay
Ciprobay Uro
Ciprocinol
Ciprodar
Ciproflox
Ciprofloxacin
Ciprofloxacina
Ciprofloxacine
Ciprofloxacino
Ciprofloxacinum
Ciprogis
Ciprolin
Ciprolon
Cipromycin
Ciproquinol
Ciprowin
Ciproxan
Ciproxina
Ciproxine
Ciriax
Citopcin
Cixan
Corsacin
Cycin
Eni
Fimoflox
HSDB 6987
Ipiflox
Italnik
Loxan
Probiox
Proflaxin
Proflox
Proksi 250
Proksi 500
Quinolid
Quintor
Rancif
Roxytal
Septicide
Sophixin Ofteno
Spitacin
Superocin
Unex
Zumaflox
ATC J01MA02
S01AX13
S03AA07
S02AA15
CID 2764
CAS 085721331
Drugbank ID DB00537
TTD Drug ID DAP001465
SMILES OC(=O)C1=CN([C@H]2CC2)C3=CC(N4CCNCC4)=C(F)C=C3C1=O
Formula C17H18FN3O3
Molweight 331.342
Atoms 24
LogP 1.9771
Rotatable Bonds 3
H-Bond Donors 0
H-Bond Acceptors 5
CYP interactions
NameRelationsReferences
1A2Inhibitor 15058617
11151749
15592331
15058617
15592331
11151749
11145498
11069211
1510417
2E1Inducer 15194011
3A4Inhibitor 8894516
umm
Transporter
AC-No.NameReferences
O15439Multidrug resistance-associated protein 419307362
Q8TCC7Solute carrier family 22 member 818381565
Q92887Canalicular multispecific organic anion transporter 119307362
Q9UNQ0ATP-binding cassette sub-family G member 218200507
Extrarenal fraction 0.5
Elimination half-life 4.0h
Dibrompropamidine

Java required.


Information Structure
Name Dibrompropamidine
Synonyms
Dibromopropamidina
Dibromopropamidine
Dibrompropamidine
Dibrompropamidinum
ATC D08AC01
S01AX14
CID 11974
CAS 000496004
SMILES NC(=N)C1=CC=C(OCCCOC2=C(Br)C=C(C=C2)C(N)=N)C(Br)=C1
Formula C17H18Br2N4O2
Molweight 470.158
Atoms 27
LogP 5.2277
Rotatable Bonds 8
H-Bond Donors 2
H-Bond Acceptors 6
Transporter
AC-No.NameReferences
O15439Multidrug resistance-associated protein 419307362
Q8TCC7Solute carrier family 22 member 818381565
Q92887Canalicular multispecific organic anion transporter 119307362
Q9UNQ0ATP-binding cassette sub-family G member 218200507
Propamidine

Java required.


Information Structure
Name Propamidine
Synonyms
4,4-(1,3-Propanediylbis(oxy))bis-benzenecarboximidamide
EINECS 203-195-2
Propamidina
Propamidine
Propamidinum
ATC D08AC03
S01AX15
CID 64949
CAS 000104325
SMILES NC(=N)C1=CC=C(OCCCOC2=CC=C(C=C2)C(N)=N)C=C1
Formula C17H20N4O2
Molweight 312.366
Atoms 23
LogP 3.7027
Rotatable Bonds 8
H-Bond Donors 0
H-Bond Acceptors 6
Transporter
AC-No.NameReferences
O15439Multidrug resistance-associated protein 419307362
Q8TCC7Solute carrier family 22 member 818381565
Q92887Canalicular multispecific organic anion transporter 119307362
Q9UNQ0ATP-binding cassette sub-family G member 218200507
Picloxydine

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Information Structure
Name Picloxydine
Synonyms
EINECS 227-084-3
Picloxidina
Picloxydine
Picloxydinum
ATC S01AX16
CID 5748610
CAS 005636920
SMILES ClC1=CC=C(NC(=N)NC(=N)N2CCN(CC2)C(=N)NC(=N)NC3=CC=C(Cl)C=C3)C=C1
Transporter
AC-No.NameReferences
O15439Multidrug resistance-associated protein 419307362
Q8TCC7Solute carrier family 22 member 818381565
Q92887Canalicular multispecific organic anion transporter 119307362
Q9UNQ0ATP-binding cassette sub-family G member 218200507
Lomefloxacin

Java required.


Information Structure
Name Lomefloxacin
Synonyms
(+-)-1-Ethyl-6,8-difluoro-1,4-dihydro-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic Acid
1,4-Dihydro-6,8-difluoro-1-ethyl-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic Acid
BRN 4210041
CCRIS 6305
DM-10
Lomefloxacin
Lomefloxacine
Lomefloxacino
Lomefloxacinum
SC 47111A
ATC J01MA07
S01AX17
CID 3948
CAS 098079517
Drugbank ID DB00978
TTD Drug ID DAP000653
SMILES CCN1C=C(C(O)=O)C(=O)C2=CC(F)=C(N3CCN[C@H](C)C3)C(F)=C12
Formula C17H19F2N3O3
Molweight 351.348
Atoms 25
LogP 2.1897
Rotatable Bonds 3
H-Bond Donors 0
H-Bond Acceptors 6
CYP interactions
NameRelationsReferences
1A2Substrate Inhibitor 1510417
umm
1510417
Transporter
AC-No.NameReferences
O15439Multidrug resistance-associated protein 419307362
Q8TCC7Solute carrier family 22 member 818381565
Q92887Canalicular multispecific organic anion transporter 119307362
Q9UNQ0ATP-binding cassette sub-family G member 218200507
Extrarenal fraction 0.2
Elimination half-life 7.5h
Povidone-iodine

Java required.


Information Structure
Name Povidone-iodine
Synonyms
1-Ethenyl-2-pyrrolidinone Homopolymer Compound With Iodine
1-Vinyl-2-pyrrolidinone Polymer W/iodine
1-Vinyl-2-pyrrolidinone Polymer, Compd. With Iodine
1-Vinyl-2-pyrrolidinone Polymer, Compound With Iodine
1-Vinyl-2-pyrrolidinone Polymers, Iodine Complex
2-Pyrrolidinone, 1-ethenyl-, Homopolymer, Compd. With Iodine
Argentyne
Betadine
Betadine (VAN)
Betaisodona
Braunol
Braunosan H
Bridine
Disadine D.P.
Disphex
Efo-dine
HSDB 6831
Inadine
Iodinated Poly(vinylpyrrolidone)
Iodine-poly(vinylpyrrolidinone)
Iodine-polyvinylpyrrolidone Complex
Iodopoly(vinyl Pyrrolidinone)
Isobetadyne
Isodine
NSC 26245
Poly(1-(2-oxo-1-pyrrolidinyl)ethylene)iodine Complex
Poly(vinylpyrrolidinone) Iodide
Poly(vinylpyrrolidinone)-iodine Complex
Poly(vinylpyrrolidone) - Iodine Complex
Poly(vinylpyrrolidone)-iodine Adduct
Polyvinylpyrrolidone Compound With Iodine
Polyvinylpyrrolidone-iodine Complex
Povadyne
Povidone Iodine
Povidone-iodine
Povidone-lodine
Proviodine
PVP Iodine
Pvp-1
PVP-I
PVP-Iodine
PVP-Iodine, 30-06
Traumasept
Ultradine
Videne
ATC D08AG02
D09AA09
D11AC06
G01AX11
R02AA15
S01AX18
CID 410087
CAS 025655418
SMILES II.CCN1CCCC1=O
Transporter
AC-No.NameReferences
O15439Multidrug resistance-associated protein 419307362
Q8TCC7Solute carrier family 22 member 818381565
Q92887Canalicular multispecific organic anion transporter 119307362
Q9UNQ0ATP-binding cassette sub-family G member 218200507
Levofloxacin

Java required.


Information Structure
Name Levofloxacin
Synonyms
(-)-Ofloxacin
(S)-(-)-Ofloxacin
(S)-9-Fluoro-2,3-dihydro-3-methyl-10-(4-methyl-1-piperazinyl)-7-oxo-7H-pyrido(1,2,3-de)-1,4-benzoxazine-6-carboxylic Acid
(S)-Ofloxacin
CCRIS 4074
DR3355
DRG-0129
Elequine
HR 355
Levaquin
Levofloxacin
Levofloxacine
Levofloxacino
Levofloxacinum
Ofloxacin S-(-)-form
RWJ 25213-097
ATC J01MA12
S01AX21
S01AX19
CID 149096
CAS 100986854
Drugbank ID DB01137
TTD Drug ID DAP000160
SMILES C[C@H]1COC2=C3N1C=C(C(O)=O)C(=O)C3=CC(F)=C2N4CCN(C)CC4
Formula C18H20FN3O4
Molweight 361.367
Atoms 27
LogP 1.5469
Rotatable Bonds 2
H-Bond Donors 0
H-Bond Acceptors 6
CYP interactions
NameRelationsReferences
1A2Inhibitor 11408986
3A4Inhibitor 11408986
Transporter
AC-No.NameReferences
P46721Solute carrier organic anion transporter family member 1A217274666
Extrarenal fraction 0.23
Elimination half-life 7h
Moxifloxacin

Java required.


Information Structure
Name Moxifloxacin
Synonyms
Moxifloxacin
ATC J01MA14
S01AX22
CID 4259
CAS 151096092
SMILES COC1=C2N(C=C(C(O)=O)C(=O)C2=CC(F)=C1N3C[C@@H]4CCCN[C@@H]4C3)[C@@H]5CC5
Formula C21H24FN3O4
Molweight 401.431
Atoms 29
LogP 2.7643
Rotatable Bonds 4
H-Bond Donors 0
H-Bond Acceptors 6
Transporter
AC-No.NameReferences
P46721Solute carrier organic anion transporter family member 1A217274666
Extrarenal fraction 0.8
Elimination half-life 12h