Aglycone
AD03136
Formula: C12H9ON3S
Smiles:
Cc1ccc(-c2nc(S)[nH]c(=O)c2C#N)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 1 |
| MolWt: | 243.29 | Num_heavy_atoms: | 17 |
| TPSA: | 69.54 | NumAromaticRings: | 2 |