Aglycone
AD39537
Formula: C12H13O2N3S
Smiles:
CN1N=C(C(=O)Nc2ccc(S)cc2)CCC1=O| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 263.32 | Num_heavy_atoms: | 18 |
| TPSA: | 61.77 | NumAromaticRings: | 1 |
