SMILES:
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(C(=O)NCCNC(=O)NC4CCN(c5ccccn5)CC4)nc32)[C@H](O)[C@@H]1OMolecular Processing
Molecular formula
C40H47N11O6
Molecular weight
777.89
Exact mass
777.3711
XLogP
1.92
TPSA
220.78
H-bond donors
7
H-bond acceptors
12
Rotatable bonds
14
Heavy atoms
57
Rings
7
Aromatic rings
5
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
0
Formal charge
0
Heteroatoms
17
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
211.49
Supplementary Information
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