Aglycone
AD12884
Formula: C12H9O2N3
Smiles:
Cc1ccc(-c2[nH]c(=O)[nH]c(=O)c2C#N)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 1 |
| MolWt: | 227.22 | Num_heavy_atoms: | 17 |
| TPSA: | 89.51 | NumAromaticRings: | 2 |