Aglycone
AD00415
Formula: C44H61O12N13S2
Smiles:
NC(=O)CNC(=O)C(CCCN=C(N)N)NC(=O)C1CCCN1C(=O)C1CSSCCC(=O)NC(Cc2ccc(O)cc2)C(=O)NC(Cc2ccccc2)C(=O)NC(CO)C(=O)NC(CC(N)=O)C(=O)N1| HBA: | 25 | RingCount: | 4 |
| HBD: | 17 | FractionCSP3: | 0.48 |
| AlogP: | -4.61 | Num_rotatable_bonds: | 17 |
| MolWt: | 1028.18 | Num_heavy_atoms: | 71 |
| TPSA: | 415.05 | NumAromaticRings: | 2 |
