Aglycone
AD00791
Formula: C13H12N5
Smiles:
Nc1nc(C#CC2=CCCCC2)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 0 |
| MolWt: | 238.27 | Num_heavy_atoms: | 18 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |