General Information of the Compound
| Compound ID |
CP0442957
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| Compound Name |
4-[3-(4-CHLOROPHENYL)-1H-PYRAZOL-5-YL]PIPERIDINE
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| Synonyms |
156336-70-8
1way
3-(4-Piperidinyl)-5-(4-chlorophenyl)pyrazole
4-(5-(4-chlorophenyl)-1H-pyrazol-3-yl)piperidine
4-[3-(4-CHLOROPHENYL)-1H-PYRAZOL-5-YL]PIPERIDINE
4-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]piperidine
7L-015
AC1L9MRB
AKOS015868501
AKOS023968186
BDBM50059237
Bionet2_000947
CHEMBL75691
DB08061
FT-0741308
GELALLNTKKLQLM-UHFFFAOYSA-N
HMS1366L01
HMS2660H19
KS-00001ZEP
L02
MCULE-8931017804
MLS000706783
MolPort-001-684-207
Oprea1_423246
SCHEMBL2598428
SMR000334280
ZINC5974200
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| Structure |
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| Formula |
C14H16ClN3
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| Molecular Weight |
261.756
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| Canonical SMILES |
Clc1ccc(cc1)-c1cc([nH]n1)C1CCNCC1
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| InChI |
InChI=1S/C14H16ClN3/c15-12-3-1-10(2-4-12)13-9-14(18-17-13)11-5-7-16-8-6-11/h1-4,9,11,16H,5-8H2,(H,17,18)
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| InChIKey |
GELALLNTKKLQLM-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01161, D(4) dopamine receptor
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Clinical Information about the Compound