이름: 3-chloromethyl-6-methoxycarbostyril
SMILES:
COc1ccc2[nH]c(=O)c(CCl)cc2c1Molecular Processing
Molecular formula
C11H10ClNO2
Molecular weight
223.66
Exact mass
223.04
XLogP
2.28
TPSA
42.09
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
60.68
Supplementary Information
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