Aglycone
AD03500
Formula: C44H41O12N9S2
Smiles:
N=c1ccc2c(-c3ccc(C(=O)NCCCCCCn4cc(CCC#Cc5cccc(CON=c6cc[nH]c(=O)[nH]6)c5)nn4)cc3C(=O)O)c3ccc(N)c(S(=O)(=O)O)c3oc-2c1S(=O)(=O)O| HBA: | 21 | RingCount: | 7 |
| HBD: | 9 | FractionCSP3: | 0.2 |
| AlogP: | 4.07 | Num_rotatable_bonds: | 17 |
| MolWt: | 952.0 | Num_heavy_atoms: | 67 |
| TPSA: | 339.1 | NumAromaticRings: | 5 |
