Aglycone

AD12360
Formula: C40H54O3N4
Smiles:
CC1(C)CCC2(C(=O)OCc3cn(-c4ccc(C#N)cc4)nn3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1HBA: | 7 | RingCount: | 7 |
HBD: | 1 | FractionCSP3: | 0.7 |
AlogP: | 8.34 | Num_rotatable_bonds: | 4 |
MolWt: | 638.9 | Num_heavy_atoms: | 47 |
TPSA: | 101.03 | NumAromaticRings: | 2 |