ID | 2833 |
Name | NSC628305 |
Pubchem ID | 363401 |
KEGG ID | N/A |
Source | N/A |
Type | Unknown |
Function | Unknown |
Drug Like Properties | Yes |
Molecular Weight | 365.43 |
Exact mass | 365.152812 |
Molecular formula | C24H19N3O |
XlogP | 4.1 |
Topological Polar Surface Area | 70.1 |
H-Bond Donor | 1 |
H-Bond Acceptor | 3 |
Rotational Bond Count | 3 |
IUPAC Name | 1-[(4-aminophenyl)methyl]-2-(benzoyl)isoquinoline-1-carbonitrile |
Structure | |
SDF file | |
MOL file | |
PDB file | |
Canonical SMILE | C1=CC=C(C=C1)C(=O)N2C=CC3=CC=CC=C3C2(CC4=CC=C(C=C4)N)C#N |
Isomeric SMILE | N/A |
Drugpedia | wiki |
References | 1. Source 2. Function 3. All Records |