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Name | SCHEMBL18357227 |
---|---|
Molecular formula | C28H28ClNO4S |
IUPAC name | 4-[3-[(2R)-2-[(E)-3-[5-(4-chloro-2-methylphenyl)thiophen-2-yl]-3-hydroxyprop-1-enyl]-5-oxopyrrolidin-1-yl]propyl]benzoic acid |
Molecular weight | 510.045 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 5.4 |
Synonyms | BDBM202460 US9540357, example 33 US9540357, example 32 |
Inchi Key | CHEGULSFMGKALD-RRPJXJBHSA-N |
Inchi ID | InChI=1S/C28H28ClNO4S/c1-18-17-21(29)8-11-23(18)25-13-14-26(35-25)24(31)12-9-22-10-15-27(32)30(22)16-2-3-19-4-6-20(7-5-19)28(33)34/h4-9,11-14,17,22,24,31H,2-3,10,15-16H2,1H3,(H,33,34)/b12-9+/t22-,24?/m0/s1 |
PubChem CID | 124170688 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 202460 |
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 |
---|---|---|---|---|---|
558545 | Prostaglandin E2 receptor EP2 subtype | P43116 | PTGER2 | Homo sapiens (Human) | 358 |
558546 | Prostaglandin E2 receptor EP4 subtype | P35408 | PTGER4 | Homo sapiens (Human) | 488 |
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