Aglycone
AD04350
Formula: C45H36O6N9S
Smiles:
O=C(Cc1ccc(NC(=O)Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2)cc1)NCCN=C(S)Nc1ccc2c(c1)C(=O)CC21c2ccc(O)cc2Oc2cc(O)ccc21| HBA: | 15 | RingCount: | 9 |
| HBD: | 6 | FractionCSP3: | 0.13 |
| AlogP: | 6.81 | Num_rotatable_bonds: | 11 |
| MolWt: | 830.91 | Num_heavy_atoms: | 61 |
| TPSA: | 213.62 | NumAromaticRings: | 6 |
