AD00950
Formula: C116H135O30N21Cl2
Smiles:
CC(C)CC1NC(=O)CNC(=O)C(c2ccc(O)cc2)NC(=O)C(C(C)O)NC(=O)C(c2ccc(O)cc2)NC(=O)C(CCCN)NC(=O)C(Cc2ccccc2)NC(=O)C(C(C)O)NC(=O)C(c2ccc(O)cc2)NC(=O)C(c2ccc(O)cc2)NC(=O)C(C(C)C)NC(=O)C(CCCN)NC(=O)C(c2ccc(O)cc2)NC(=O)C(CNC(=O)C(CC(N)=O)NC(=O)c2ccc(OCc3cccc(Cl)c3)cc2)C(C(N)=O)OC(=O)C(c2ccc(O)c(Cl)c2)NC(=O)C(C)NC1=O
HBA: |
51 |
RingCount: |
10 |
HBD: |
33 |
FractionCSP3: |
0.35 |
AlogP: |
0.27 |
Num_rotatable_bonds: |
30 |
MolWt: |
2350.36 |
Num_heavy_atoms: |
167 |
TPSA: |
830.29 |
NumAromaticRings: |
9 |