Compound - Results

Cimetidine

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Information Structure
Name Cimetidine
Synonyms
1-Cyano-2-methyl-3-(2-(((5-methyl-4-imidazolyl)methyl)thio)ethyl)guanidine
2-Cyano-1-methyl-3-(2-(((5-methylimidazol-4-yl)methyl)thio)ethyl)guanidine
Acibilin
Acinil
CCRIS 3247
Cimal
Cimetag
Cimetidina
Cimetidine
Cimetidinum
Cimetum
DRG-0150
Dyspamet
Edalene
EINECS 257-232-2
Eureceptor
Gastromet
Guanidine, N-cyano-N-methyl-N-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio) Ethyl)-
HSDB 3917
Metracin
N-Cyano-N-methyl-N-(2-(((5-methyl-1H-imidazol-4-yl)methyl)thio)ethyl)guanidine
SKF 92334
Tagamet
Tametin
Tratul
Ulcedine
Ulcimet
Ulcomet
ATC A02BA01
CID 2756
CAS 051481619
Drugbank ID DB00501
TTD Drug ID DAP000338
SMILES CNC(NCCSCC1=C(C)NC=N1)=N/C#N
Formula C10H16N6S
Molweight 252.339
Atoms 17
LogP 1.37918
Rotatable Bonds 7
H-Bond Donors 0
H-Bond Acceptors 6
CYP interactions
NameRelationsReferences
1A2Inhibitor 10223772
10223772
2C8Inhibitor umm
2C9Inhibitor umm
11334262
2C19Inhibitor umm
11334262
11067738
16276979
2D6Inhibitor 10664926
11334262
10223772
8063004
2E1Inhibitor umm
10411963
8126258
1955133
11996015
3A4Inhibitor 10223772
16276979
3A5Inhibitor 10223772
3A7Inhibitor 10223772
11B1Inhibitor 3023203
Phase2 interactions
NameReferences
NAT 1371435
Transporter
AC-No.NameReferences
O15244Solute carrier family 22 member 219144690
O15245Solute carrier family 22 member 117614008
Q4U2R8Solute carrier family 22 member 615377641
Q92887Canalicular multispecific organic anion transporter 116316932
Q9H015Solute carrier family 22 member 420977453
Q9UNQ0ATP-binding cassette sub-family G member 216809480
Extrarenal fraction 0.3
Elimination half-life 2h
Ranitidine

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Information Structure
Name Ranitidine
Synonyms
Achedos
Acidex
Atural
Axoban
Coralen
Curan
Duractin
EINECS 266-332-5
Ezopta
Gastrial
Gastrosedol
HSDB 3925
Istomar
Logast
Mauran
Microtid
N-(2-((5-((Dimethylamino)methyl)furfuryl)thio)ethyl)-N-methyl-2-nitro-1,1-ethenediamine
Ptinolin
Quantor
Quicran
Radinat
Randin
Ranidine
Ranin
Raniogas
Ranisen
Raniter
Ranitidina
Ranitidine
Ranitidinum
Ranitiget
Rantacid
Ratic
Raticina
RND
Sampep
Taural
Ul-Pep
Ulceranin
Urantac
Verlost
Vesyca
Vizerul
Weichilin
Weidos
Xanidine
Zantab
Zantadin
ATC A02BA02
CID 3001055
CAS 066357355
Drugbank ID DB00863
TTD Drug ID DAP000340
SMILES CNC(NCCSCC1=CC=C(CN(C)C)O1)=C/[N+]([O-])=O
Formula C13H22N4O3S
Molweight 314.404
Atoms 22
LogP 2.764
Rotatable Bonds 10
H-Bond Donors 0
H-Bond Acceptors 6
CYP interactions
NameRelationsReferences
1A2Substrate Inhibitor umm
11128045
11996015
10223772
10223772
2C19Substrate umm
11128045
2D6Substrate Inhibitor 10223772
umm
11128045
3A4Inhibitor 10223772
3A5Inhibitor 10223772
Phase2 interactions
NameReferences
UGT 11400910
Transporter
AC-No.NameReferences
Q86UG4Cancer/testis antigen 48 17895592
Q8TCC7hOAT316006492
Q9Y694Solute carrier family 22 member 716006492
Extrarenal fraction 0.25
Elimination half-life 2.5h
Famotidine

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Information Structure
Name Famotidine
Synonyms
(1-Amino-3-(((2-((diaminomethylene)amino)-4-thiazolyl)methyl)thio)propylidene)sulfamide
3-(((2-((Aminoiminomethyl)amino)-4-thiazolyl)methyl)thio)-N-(aminosulfonyl)propanimidamide
3-(((2-((Diaminomethylene)amino)-4-thiazolyl)methyl)thio)-N(sup 2)-sulfamoylpropionamidine
Amfamox
Antodine
Apo-Famotidine
Apogastine
Bestidine
Blocacid
Brolin
Cepal
Confobos
Cronol
Cuantin
Dibrit 40
Digervin
Dinul
Dipsin
Dispromil
Dispronil
Duovel
Durater
Evatin
Fadin
Fadine
Fadyn
Fagastine
Famo
Famocid
Famodar
Famodil
Famodin
Famodine
Famogard
Famonit
Famopsin
Famos
Famosan
Famotal
Famotep
Famotidina
Famotidine
Famotidinum
Famotin
Famovane
Famowal
Famox
Famoxal
Famtac
Famulcer
Fanobel
Fanosin
Fanox
Farmotex
Ferotine
Fibonel
Fudone
Ganor
Gaster
Gastridan
Gastridin
Gastrion
Gastro
Gastrodomina
Gastrofam
Gastropen
Gastrosidin
H2 Bloc
Hacip
HSDB 3572
Huberdina
Ingastri
Invigan
L 643341
Lecedil
Logos
Mensoma
Midefam
MK 208
Mosul
Motiax
Muclox
Mylanta AR
N-Sulfamoyl-3-((2-guanidinothiazol-4-yl)methylthio)propionamide
Neocidine
Nevofam
Notidin
Novo-Famotidine
Nu-Famotidine
Nulceran
Nulcerin
Panalba
Pepcid
Pepcid AC
Pepcidac
Pepcidin
Pepcidin Rapitab
Pepcidina
Pepcidine
Pepdif
Pepdine
Pepdul
Pepfamin
Peptan
Peptidin
Peptifam
Pepzan
Propanimidamide, N-(aminosulfonyl)-3-(((2-((diaminomethylene)amino)-4-thiazoly)methyl)thio)-
Purifam
Quamatel
Quamtel
Renapepsa
Restadin
Rogasti
Rubacina
Sedanium-R
Sigafam
Supertidine
Tairal
Tamin
Tipodex
Topcid
Ulcatif
Ulceprax
Ulcofam
Ulfagel
Ulfam
Ulfamid
Ulfinol
Ulgarine
Vagostal
Weimok
Whitidin
Yamarin
YM 11170
YM-11170
ATC A02BA03
CID 3325
CAS 076824356
Drugbank ID DB00927
TTD Drug ID DAP000341
SMILES NC(N)=NC1=NC(CSCCC(N)=N/S(N)(=O)=O)=CS1
Formula C8H15N7O2S3
Molweight 337.445
Atoms 20
LogP 2.9869
Rotatable Bonds 9
H-Bond Donors 0
H-Bond Acceptors 9
CYP interactions
NameRelationsReferences
2C19Substrate 17112810
Transporter
AC-No.NameReferences
Q4U2R8hOAT115496291
Q8TCC7Solute carrier family 22 member 815496291
Extrarenal fraction 0.2
Elimination half-life 3h
Nizatidine

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Information Structure
Name Nizatidine
Synonyms
1,1-Ethenediamine, N-(2-(((2-((dimethylamino)methyl)-4-thiazoly)methyl)thio)ethyl)-N-methyl-2-nitro-
Acinon
Antizid
Axid
BRN 4846056
Calmaxid
Cronizat
Distaxid
Galitidin
Gastrax
HSDB 3574
LY 139037
N-(2-(((2-((Dimethylamino)methyl)-4-thiazolyl)methyl)thio)ethyl)-N-methyl-2-nitro-1,1-ethenediamine
N-(4-(6-Methylamino-7-nitro-2-thia-5-aza-6-hepten-1-yl)-2-thiazolylmethyl)-N,N-dimethylamin
Naxidine
Nizatidina
Nizatidine
Nizatidinum
Nizax
Nizaxid
Panaxid
Splendil ER
Tazac
Ulcosol
Ulxid
Zanizal
ZE-101
Zinga
ZL-101
ATC A02BA04
CID 3033637
CAS 076963412
Drugbank ID DB00585
TTD Drug ID DAP000339
SMILES CNC(NCCSCC1=CSC(CN(C)C)=N1)=C/[N+]([O-])=O
Formula C12H21N5O2S2
Molweight 331.457
Atoms 22
LogP 2.6275
Rotatable Bonds 10
H-Bond Donors 0
H-Bond Acceptors 6
Transporter
AC-No.NameReferences
Q4U2R8hOAT115496291
Q8TCC7Solute carrier family 22 member 815496291
Extrarenal fraction 0.3
Elimination half-life 1.5h
Niperotidine

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Information Structure
Name Niperotidine
Synonyms
EINECS 284-304-0
Niperotidina
Niperotidine
Niperotidinum
Piperonyl-ranitidine
ATC A02BA05
CID 3033952
CAS 084845750
SMILES CN(C)CC1=CC=C(CSCCN[C@H](C[N+]([O-])=O)NCC2=CC=C3OCOC3=C2)O1
Transporter
AC-No.NameReferences
Q4U2R8hOAT115496291
Q8TCC7Solute carrier family 22 member 815496291
Roxatidine

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Information Structure
Name Roxatidine
Synonyms
Desacetyl-tzu-0460
Roxatidine
ATC A02BA06
CID 91276
CAS 078273800
SMILES OCC(=O)NCCCOC1=CC=CC(CN2CCCCC2)=C1
Formula C17H26N2O3
Molweight 306.4
Atoms 22
LogP 1.8787
Rotatable Bonds 9
H-Bond Donors 0
H-Bond Acceptors 5
CYP interactions
NameRelationsReferences
2A6Substrate 11556126
2D6Substrate 11556126
Transporter
AC-No.NameReferences
Q4U2R8hOAT115496291
Q8TCC7Solute carrier family 22 member 815496291
Ranitidine Bismuth Citrate

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Information Structure
Name Ranitidine bismuth citrate
Synonyms
Azamplus
Elicodil
Helirad
N-(2-((5-((Dimethylamino)methyl)furfuryl)thio)ethyl)-N-methyl-2-nitro-1,1-ethenediamine, Compound With Bismuth(3(+)) Citrate (1:1)
Pylorisan
Ranitidine Bismuth Citrate
Tritec
ATC A02BA07
CID 3033887
CAS 128345620
SMILES CNC(NCCSCC1=CC=C(CN(C)C)O1)=C/[N+]([O-])=O
Formula C19H27BiN4O10S
Molweight 712.484
Atoms 36
LogP -2.4886
Rotatable Bonds 15
H-Bond Donors 0
H-Bond Acceptors 13
Transporter
AC-No.NameReferences
Q4U2R8hOAT115496291
Q8TCC7Solute carrier family 22 member 815496291
Lafutidine

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Information Structure
Name Lafutidine
Synonyms
(+-)-2-(Furfurylsulfinyl)-N-(4-(4-(piperidinomethyl)-2-pyridyl)oxy-(Z)-2-butenyl)acetamide
FRG-8813
Lafutidine
N-(4-(4-Piperidinylmethyl)pyridyl-2-oxy)butenyl-2-(furfurylsulfinyl)acetamide
ATC A02BA08
CID 5282136
CAS 118288087
SMILES O=C(CS(=O)CC1=CC=CO1)NCC=C/COC2=NC=CC(CN3CCCCC3)=C2
Formula C22H29N3O4S
Molweight 431.548
Atoms 32
LogP 3.8551
Rotatable Bonds 12
H-Bond Donors 0
H-Bond Acceptors 7
CYP interactions
NameRelationsReferences
2C19Inhibitor 14653835
Transporter
AC-No.NameReferences
Q4U2R8hOAT115496291
Q8TCC7Solute carrier family 22 member 815496291