Aglycone
AD00441
Formula: C26H19O2N3S
Smiles:
COc1ccc(-c2c(C(=O)Nc3ccccc3)c(-c3ccccc3)[nH]c(=S)c2C#N)cc1| HBA: | 5 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.04 |
| AlogP: | 6.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 437.52 | Num_heavy_atoms: | 32 |
| TPSA: | 77.91 | NumAromaticRings: | 4 |