Aglycone

AD57158
Formula: C49H54O9N6
Smiles:
N=C(N)NCCCC(O)C1C=CC2(C34c5c(O)cccc5CCC3CCCC4CO)C(=CC3(C(=O)O)C2c2cc(O)c(O)cc2N3C(=O)C=Cc2ccc(O)c(Cc3cnc[nH]3)c2)C1HBA: | 15 | RingCount: | 9 |
HBD: | 12 | FractionCSP3: | 0.39 |
AlogP: | 5.21 | Num_rotatable_bonds: | 12 |
MolWt: | 871.0 | Num_heavy_atoms: | 64 |
TPSA: | 269.57 | NumAromaticRings: | 4 |