SMILES:
COc1cc2c(N)nc(N3CCC(N4Cc5ccccc5C4=O)CC3)nc2c(OC)c1OC.ClMolecular Processing
Molecular formula
C24H28ClN5O4
Molecular weight
485.97
Exact mass
485.183
XLogP
3.28
TPSA
103.04
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
34
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
2
Fraction Csp3
0.375
Molar refractivity
132.4
Supplementary Information
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