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Ligand

NameCHEMBL351387
Molecular formulaC25H25N5O3S
IUPAC name(2S)-N-benzhydryl-1-[(2-nitroanilino)carbamothioyl]pyrrolidine-2-carboxamide
Molecular weight475.567
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP5.5
Synonyms(2S)-N-Benzhydryl-1-[2-(2-nitrophenyl)hydrazinocarbonothioyl]pyrrolidine-2-carboxamide
Inchi KeyRDLJFYDPHNQKHM-QFIPXVFZSA-N
Inchi IDInChI=1S/C25H25N5O3S/c31-24(26-23(18-10-3-1-4-11-18)19-12-5-2-6-13-19)22-16-9-17-29(22)25(34)28-27-20-14-7-8-15-21(20)30(32)33/h1-8,10-15,22-23,27H,9,16-17H2,(H,26,31)(H,28,34)/t22-/m0/s1
PubChem CID10344874
ChEMBLCHEMBL351387
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
293456B2 bradykinin receptorP25023Bdkrb2Rattus norvegicus (Rat)396
293457Substance-P receptorP14600Tacr1Rattus norvegicus (Rat)407
293458Substance-P receptorP30547TACR1Cavia porcellus (Guinea pig)407
293459Substance-P receptorP25103TACR1Homo sapiens (Human)407

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