Aglycone

AD11962
Formula: C44H36O7N9S
Smiles:
O=C1C=CC2C(=C1)Oc1cc(O)ccc1C2c1ccc(NC(=S)NCCNC(=O)Cc2ccc(NC(=O)Cc3ccc(Nc4ncnc5c4N=C[N]5)cc3)cc2)cc1C(=O)OHBA: | 16 | RingCount: | 8 |
HBD: | 7 | FractionCSP3: | 0.14 |
AlogP: | 5.52 | Num_rotatable_bonds: | 13 |
MolWt: | 834.89 | Num_heavy_atoms: | 61 |
TPSA: | 230.36 | NumAromaticRings: | 5 |