Compound - Results

Pizotifen

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Information Structure
Name Pizotifen
Synonyms
4-(9,10-Dihydro-4H-benzo(4,5)cyclohepta(1,2-b)thien-4-ylidene)-1-methylpiperidine
BC 105
BRN 0753534
EINECS 239-632-9
Litec
Pizotifen
Pizotifene
Pizotifeno
Pizotifenum
Pizotyline
Sandomigran
Sandomygran
ATC A15AA02
N02CX01
CID 27400
CAS 015574966
SMILES CN1CCC(CC1)=C2C3=C(CCC4=C2C=CC=C4)SC=C3
Formula C19H21NS
Molweight 295.442
Atoms 21
LogP 4.3121
Rotatable Bonds 0
H-Bond Donors 0
H-Bond Acceptors 1
Clonidine

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Information Structure
Name Clonidine
Synonyms
1H-Imidazol-2-amine, N-(2,6-dichlorophenyl)-4,5-dihydro-
2,6-Dichloro-N-2-imidazolidinylidenebenzenamine
2-((2,6-Dichlorophenyl)imino)imidazolidine
2-(2,6-Dichloroanilino)-1,3-diazacyclopentene-(2)
2-(2,6-Dichloroanilino)-2-imidazoline
2-(2,6-Dichlorophenylamino)-2-imidazoline
734571A
Adesipress
Benzenamine, 2,6-dichloro-N-2-imidazolidinylidene-
Catapres-TTS
Catarpres
Catarpresan
CCRIS 7787
Chlornidinum
Clonidin
Clonidina
Clonidine
Clonidinum
Duraclon
EINECS 224-119-4
HSDB 3040
M-5041T
ST-155-BS
ATC C02AC01
N02CX02
S01EA04
CID 2803
CAS 004205907
Drugbank ID DB00575
TTD Drug ID DAP000231
SMILES ClC1=CC=CC(Cl)=C1NC2=NCCN2
Formula C9H9Cl2N3
Molweight 230.094
Atoms 14
LogP 2.2019
Rotatable Bonds 2
H-Bond Donors 0
H-Bond Acceptors 3
CYP interactions
NameRelationsReferences
19AInducer 1507273
Phase2 interactions
NameReferences
NAT 2568481,
2878334
Transporter
AC-No.NameReferences
P52569Low affinity cationic amino acid transporter 2 18809522
Extrarenal fraction 0.4
Elimination half-life 15h
Iprazochrome

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Information Structure
Name Iprazochrome
Synonyms
1-Isopropyl-3-hydroxy-5-semicarbazone-6-oxo-2,3,5,6-tetrahydroindole
5,6-Indolinedione, 3-hydroxy-1-isopropyl-, 5-semicarbazone
Divascan
Iprazochrome
Iprazochromum
Iprazocromo
ISI
Isopropylnoradenochrome Monosemicarbazone
Isopropylnoradrenochrome Monosemicarbazone
Novochrome
NSC 10065
ATC N02CX03
CID 6381821
CAS 007248217
SMILES CC(C)N1C[C@@H](O)C2=CC(=NNC(N)=O)C(=O)C=C12
Formula C12H16N4O3
Molweight 264.28
Atoms 19
LogP 0.5177
Rotatable Bonds 3
H-Bond Donors 0
H-Bond Acceptors 6
Transporter
AC-No.NameReferences
P52569Low affinity cationic amino acid transporter 2 18809522
Dimetotiazine

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Information Structure
Name Dimetotiazine
Synonyms
10-(2-(Dimethylamino)propyl)-N,N-dimethylphenothiazine-2-sulfonamide
3-Dimethylsulfonamido 10-(2-dimethylaminopropyl)phenothiazine
Banistyl
Bayer 1483
BRN 0941549
Dimethodin
Dimethothiazine
Dimethylsulfamido-3-(dimethylamino-2-propyl)-10-phenothiazine
Dimetiotazine
Dimetotiazina
Dimetotiazine
Dimetotiazinum
EINECS 231-229-6
Fonazine
IL 6302
N,N-Dimethyl-10-(2-dimethylaminopropyl)-2-phenothiazinylsulfonamid
R.P. 8599
ATC N02CX05
CID 3089
CAS 007456248
SMILES C[C@@H](CN1C2=C(SC3=CC=C(C=C13)S(=O)(=O)N(C)C)C=CC=C2)N(C)C
Formula C19H25N3O2S2
Molweight 391.551
Atoms 26
LogP 4.6355
Rotatable Bonds 5
H-Bond Donors 0
H-Bond Acceptors 4
CYP interactions
NameRelationsReferences
3A4Inhibitor 8849485
11996015
Transporter
AC-No.NameReferences
P52569Low affinity cationic amino acid transporter 2 18809522
Oxetorone

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Information Structure
Name Oxetorone
Synonyms
3-(12H-Benzofuro(3,2-c)(1)benzoxepin-6-yliden)-N,N-dimethylpropylamin
EINECS 247-411-3
N,N-Dimethylbenzofuro(3,2-c)(1)benzoxepin-delta6(12H),gamma-propylamine
Oxetorona
Oxetorone
Oxetoronum
ATC N02CX06
CID 6436540
CAS 026020553
SMILES CN(C)CCC=C1/C2=C(COC3=C1C=CC=C3)C4=CC=CC=C4O2
Formula C21H21NO2
Molweight 319.397
Atoms 24
LogP 4.7086
Rotatable Bonds 3
H-Bond Donors 0
H-Bond Acceptors 3
Transporter
AC-No.NameReferences
P52569Low affinity cationic amino acid transporter 2 18809522