Name: ( 120 )
SMILES:
COc1ccc2c(c1)c1c3c(c(-c4ccccc4Cl)cc1n2CCC(=O)NCCN1CCOCC1)C(=O)NC3=OMolecular Processing
Molecular formula
C30H29ClN4O5
Molecular weight
561.04
Exact mass
560.1826
XLogP
3.85
TPSA
101.9
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
40
Rings
6
Aromatic rings
4
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
153.12
Supplementary Information
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