Aglycone
AD40754
Formula: C9H12O2N5
Smiles:
[NH3+]CCc1cnn(-c2c[nH]c(=O)[nH]c2=O)c1| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.22 |
| AlogP: | -1.97 | Num_rotatable_bonds: | 3 |
| MolWt: | 222.23 | Num_heavy_atoms: | 16 |
| TPSA: | 111.18 | NumAromaticRings: | 2 |