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Ligand

NameCHEMBL3752901
Molecular formulaC27H35F3N4O5
IUPAC nameN-[(2S)-3-cyclohexyl-1-[[(2S,3S)-3-methyl-1-oxo-1-[[3-(trifluoromethoxy)phenyl]methylamino]pentan-2-yl]amino]-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
Molecular weight552.595
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP6.2
SynonymsN/A
Inchi KeyCPWVUABICWUOPN-HYVJGQCMSA-N
Inchi IDInChI=1S/C27H35F3N4O5/c1-3-17(2)23(26(37)31-16-19-10-7-11-20(14-19)38-27(28,29)30)34-24(35)21(15-18-8-5-4-6-9-18)33-25(36)22-12-13-32-39-22/h7,10-14,17-18,21,23H,3-6,8-9,15-16H2,1-2H3,(H,31,37)(H,33,36)(H,34,35)/t17-,21-,23-/m0/s1
PubChem CID56639886
ChEMBLCHEMBL3752901
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
522925Proteinase-activated receptor 2P55085F2RL1Homo sapiens (Human)397

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