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Name | CHEMBL412037 |
---|---|
Molecular formula | C37H24N4Na6O23S6 |
IUPAC name | hexasodium;8-[[4-methoxy-3-[[2-methoxy-5-[(4,6,8-trisulfonatonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonate |
Molecular weight | 1222.9 |
Hydrogen bond acceptor | 23 |
Hydrogen bond donor | 4 |
XlogP | None |
Synonyms | N/A |
Inchi Key | XSLQMENDIIKEOZ-UHFFFAOYSA-H |
Inchi ID | InChI=1S/C37H30N4O23S6.6Na/c1-63-27-7-3-17(35(42)38-23-5-9-29(67(51,52)53)21-13-19(65(45,46)47)15-31(33(21)23)69(57,58)59)11-25(27)40-37(44)41-26-12-18(4-8-28(26)64-2)36(43)39-24-6-10-30(68(54,55)56)22-14-20(66(48,49)50)16-32(34(22)24)70(60,61)62;;;;;;/h3-16H,1-2H3,(H,38,42)(H,39,43)(H2,40,41,44)(H,45,46,47)(H,48,49,50)(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62);;;;;;/q;6*+1/p-6 |
PubChem CID | 11579046 |
ChEMBL | CHEMBL412037 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
399781 | P2Y purinoceptor 1 | P47900 | P2RY1 | Homo sapiens (Human) | 373 |
399782 | P2Y purinoceptor 11 | Q96G91 | P2RY11 | Homo sapiens (Human) | 374 |
399780 | P2Y purinoceptor 2 | P41231 | P2RY2 | Homo sapiens (Human) | 377 |
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