SMILES:
COc1cccc(-c2ccc3c(c2)NC(=O)C3=Cc2[nH]c3c(c2CCC(=O)O)CCCC3)c1Molecular Processing
Molecular formula
C27H26N2O4
Molecular weight
442.52
Exact mass
442.1893
XLogP
5.08
TPSA
91.42
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
33
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.259
Molar refractivity
128.32
Supplementary Information
Obteniendo detalles…
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