ID | 1877 |
Name | Colchicine analog |
Pubchem ID | 341041 |
KEGG ID | N/A |
Source | N/A |
Type | Unknown |
Function | Unknown |
Drug Like Properties | Yes |
Molecular Weight | 473.58 |
Exact mass | 473.187208 |
Molecular formula | C25H31NO6S |
XlogP | 3.4 |
Topological Polar Surface Area | 83.1 |
H-Bond Donor | 1 |
H-Bond Acceptor | 6 |
Rotational Bond Count | 9 |
IUPAC Name | butylN-[(7S)-1,2,3-trimethoxy-10-methylsulfanyl-9-oxo-6,7-dihydro-5H-benzo[d]heptalen-7-yl]carbamate |
Structure | |
SDF file | |
MOL file | |
PDB file | |
Canonical SMILE | CCCCOC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC |
Isomeric SMILE | CCCCOC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC |
Drugpedia | wiki |
References | 1. Source 2. Function 3. All Records |