이름: 5-Chloro-3-prop-1-ynyl-pyridin-2-ylamine
SMILES:
CC#Cc1cc(Cl)cnc1NMolecular Processing
Molecular formula
C8H7ClN2
Molecular weight
166.61
Exact mass
166.0298
XLogP
1.69
TPSA
38.91
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
46.21
Supplementary Information
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