Aglycone
AD35533
Formula: C12H16N2S
Smiles:
CN1CCC=C(Nc2ccc(S)cc2)C1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.33 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 2 |
| MolWt: | 220.34 | Num_heavy_atoms: | 15 |
| TPSA: | 15.27 | NumAromaticRings: | 1 |