Aglycone
AD00444
Formula: C8H8N2S
Smiles:
Cc1cc(C)c(C#N)c(=S)[nH]1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 2.23 | Num_rotatable_bonds: | 0 |
| MolWt: | 164.23 | Num_heavy_atoms: | 11 |
| TPSA: | 39.58 | NumAromaticRings: | 1 |
