Aglycone
AD13680
Formula: C9H7N3SI
Smiles:
C=CCSc1ncnc2c1C(I)=C[N]2| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 2.74 | Num_rotatable_bonds: | 3 |
| MolWt: | 316.15 | Num_heavy_atoms: | 14 |
| TPSA: | 39.88 | NumAromaticRings: | 1 |