COc1cc2c(Nc3cc(CC(=O)O)[nH]n3)ncnc2cc1OCCC1CCN(CCOC(C)(C)C)CC1
SMILES: COc1cc2c(Nc3cc(CC(=O)O)[nH]n3)ncnc2cc1OCCC1CCN(CCOC(C)(C)C)CC1

Molecular Processing

Molecular formula
C27H38N6O5
Molecular weight
526.64
Exact mass
526.2904
XLogP
4.03
TPSA
134.72
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
12
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
144.28

Supplementary Information

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