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Name | CHEMBL179837 |
---|---|
Molecular formula | C35H37ClN4O4S |
IUPAC name | N-[(2R)-3-(4-chlorophenyl)-1-[4-[2-[cyclopropylmethyl(methylsulfonyl)amino]phenyl]piperazin-1-yl]-1-oxopropan-2-yl]naphthalene-2-carboxamide |
Molecular weight | 645.215 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 6.1 |
Synonyms | BDBM50162716 Naphthalene-2-carboxylic acid ((R)-1-(4-chloro-benzyl)-2-{4-[2-(cyclopropylmethyl-methanesulfonyl-amino)-phenyl]-piperazin-1-yl}-2-oxo-ethyl)-amide |
Inchi Key | AMAVLJGPQBNVJH-WJOKGBTCSA-N |
Inchi ID | InChI=1S/C35H37ClN4O4S/c1-45(43,44)40(24-26-10-11-26)33-9-5-4-8-32(33)38-18-20-39(21-19-38)35(42)31(22-25-12-16-30(36)17-13-25)37-34(41)29-15-14-27-6-2-3-7-28(27)23-29/h2-9,12-17,23,26,31H,10-11,18-22,24H2,1H3,(H,37,41)/t31-/m1/s1 |
PubChem CID | 44390422 |
ChEMBL | CHEMBL179837 |
IUPHAR | N/A |
BindingDB | 50162716 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
8708 | Melanocortin receptor 4 | P32245 | MC4R | Homo sapiens (Human) | 332 |
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