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Name | BDBM79970 |
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Molecular formula | C17H19N5O2S |
IUPAC name | 3-(1-cyclohexyltetrazol-5-yl)sulfanyl-1-phenylpyrrole-2,5-diol |
Molecular weight | 357.432 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 4.0 |
Synonyms | 3-[(1-cyclohexyl-5-tetrazolyl)thio]-1-phenylpyrrolidine-2,5-dione 3-[(1-cyclohexyltetrazol-5-yl)thio]-1-phenyl-pyrrolidine-2,5-quinone cid_2973118 3-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-phenyl-pyrrolidine-2,5-dione |
Inchi Key | AWFKRCSXWSVESV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H19N5O2S/c23-15-11-14(16(24)21(15)12-7-3-1-4-8-12)25-17-18-19-20-22(17)13-9-5-2-6-10-13/h1,3-4,7-8,11,13,23-24H,2,5-6,9-10H2 |
PubChem CID | 136664533 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 79970 |
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 |
---|---|---|---|---|---|
557720 | C-C chemokine receptor type 6 | P51684 | CCR6 | Homo sapiens (Human) | 374 |
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