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Name | CHEMBL41132 |
---|---|
Molecular formula | C16H17NO2S |
IUPAC name | (1S,10S)-15-methyl-16-thia-11-azatetracyclo[8.7.0.02,7.013,17]heptadeca-2,4,6,13(17),14-pentaene-4,5-diol |
Molecular weight | 287.377 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 3 |
XlogP | 2.6 |
Synonyms | SCHEMBL7009451 2-Methyl-4,5,5aalpha,6,7,11bbeta-hexahydro-1-thia-5-aza-1H-cyclopenta[c]phenanthrene-9,10-diol (5aS,11bS)-2-Methyl-4,5,5a,6,7,11b-hexahydro-1-thia-5-aza-cyclopenta[c]phenanthrene-9,10-diol BDBM50057846 |
Inchi Key | GYRLGNMXIAYTEM-WFASDCNBSA-N |
Inchi ID | InChI=1S/C16H17NO2S/c1-8-4-10-7-17-12-3-2-9-5-13(18)14(19)6-11(9)15(12)16(10)20-8/h4-6,12,15,17-19H,2-3,7H2,1H3/t12-,15-/m0/s1 |
PubChem CID | 10684715 |
ChEMBL | CHEMBL41132 |
IUPHAR | N/A |
BindingDB | 50057846 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
108546 | D(1) dopamine receptor | P35406 | Carassius auratus (Goldfish) | 363 | |
108548 | D(1A) dopamine receptor | P18901 | Drd1 | Rattus norvegicus (Rat) | 446 |
108547 | D(2) dopamine receptor | P61169 | Drd2 | Rattus norvegicus (Rat) | 444 |
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