Aglycone
AD12003
Formula: C14H12O2N5S
Smiles:
Nc1nc(SCCc2ccc(C(=O)O)cc2)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | 2.0 | Num_rotatable_bonds: | 5 |
| MolWt: | 314.35 | Num_heavy_atoms: | 22 |
| TPSA: | 115.56 | NumAromaticRings: | 2 |