SMILES:
CS(=O)(=O)Nc1cc(OCC(O)CN(Cc2ccccc2)C2CCC(c3ccc(C(=O)NC(Cc4ccccc4)C(=O)O)cc3)CC2)ccc1OCc1ccccc1Molecular Processing
Molecular formula
C46H51N3O8S
Molecular weight
805.99
Exact mass
805.3397
XLogP
7.03
TPSA
154.5
H-bond donors
4
H-bond acceptors
8
Rotatable bonds
19
Heavy atoms
58
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
224.51
Supplementary Information
Загрузка подробностей…
Участвует в 1 реакциях→