AD12523
Formula: C100H167O39N28P3S2
Smiles:
COP(=O)(O)OP(=O)(O)OP(=O)(O)OC1CC(=O)N(CCOCCOCCOCCN2C(=O)CC(SC(NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(CC(=O)O)NC(=O)C(Cc3ccccc3)NC(=O)C(C)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(N)=O)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CC(C)C)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)CCCCC3SCC4NC(=O)NC43)C(=O)O)C2=O)C1=O
HBA: |
67 |
RingCount: |
5 |
HBD: |
38 |
FractionCSP3: |
0.69 |
AlogP: |
-6.53 |
Num_rotatable_bonds: |
88 |
MolWt: |
2542.65 |
Num_heavy_atoms: |
172 |
TPSA: |
1056.65 |
NumAromaticRings: |
1 |