Aglycone
AD42774
Formula: C12H9ON5I
Smiles:
COc1cccc(Nc2nc(I)nc3c2N=C[N]3)c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.74 | Num_rotatable_bonds: | 3 |
| MolWt: | 366.14 | Num_heavy_atoms: | 19 |
| TPSA: | 73.5 | NumAromaticRings: | 2 |