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Name | 4-(Diphenylmethyl)-1-[4-(aminosulfonyl)-2-nitrophenyl]thiosemicarbazide |
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Molecular formula | C20H19N5O4S2 |
IUPAC name | [4-[2-(benzhydrylazaniumyl)carbothioylhydrazinyl]-3-nitrophenyl]sulfonylazanide |
Molecular weight | 457.523 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 4 |
XlogP | 4.0 |
Synonyms | N/A |
Inchi Key | SJNKRQGJVIUJJM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H19N5O4S2/c21-31(28,29)16-11-12-17(18(13-16)25(26)27)23-24-20(30)22-19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,19,23H,(H4,21,22,24,28,29,30) |
PubChem CID | 101029625 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50085684 |
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 |
---|---|---|---|---|---|
454250 | B2 bradykinin receptor | P25023 | Bdkrb2 | Rattus norvegicus (Rat) | 396 |
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