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Name | CHEMBL495202 |
---|---|
Molecular formula | C24H32F6N2O2 |
IUPAC name | (1S,3R)-N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-3-[[(3S,4S)-3-methyloxan-4-yl]amino]-1-propan-2-ylcyclopentane-1-carboxamide |
Molecular weight | 494.522 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 5.3 |
Synonyms | (1S,3R)-N-(3,5-bis(trifluoromethyl)benzyl)-1-isopropyl-3-((3S,4S)-3-methyltetrahydro-2H-pyran-4-ylamino)cyclopentanecarboxamide BDBM50315028 cis-(1S,3R)-N-(3,5-bis(trifluoromethyl)benzyl)-1-isopropyl-3-(3-methyltetrahydro-2H-pyran-4-ylamino)cyclopentanecarboxamide |
Inchi Key | AWFVUZFXTNVVQX-DZUANBCISA-N |
Inchi ID | InChI=1S/C24H32F6N2O2/c1-14(2)22(6-4-19(11-22)32-20-5-7-34-13-15(20)3)21(33)31-12-16-8-17(23(25,26)27)10-18(9-16)24(28,29)30/h8-10,14-15,19-20,32H,4-7,11-13H2,1-3H3,(H,31,33)/t15-,19-,20+,22+/m1/s1 |
PubChem CID | 25256791 |
ChEMBL | CHEMBL495202 |
IUPHAR | N/A |
BindingDB | 50315028 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
15985 | C-C chemokine receptor type 2 | P41597 | CCR2 | Homo sapiens (Human) | 374 |
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