OC1(CNc2ccnc3cc(Cl)ccc23)CCCCC1
Название: 7-chloro-N-(1-hydroxycyclohexylmethyl)-4-quinolinamine
SMILES: OC1(CNc2ccnc3cc(Cl)ccc23)CCCCC1

Molecular Processing

Molecular formula
C16H19ClN2O
Molecular weight
290.79
Exact mass
290.1186
XLogP
4
TPSA
45.15
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
83.28

Supplementary Information

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