O=C(O)c1cc2ncc(Cl)cn2n1
Name: 6-chloro-pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
SMILES: O=C(O)c1cc2ncc(Cl)cn2n1

Molecular Processing

Molecular formula
C7H4ClN3O2
Molecular weight
197.58
Exact mass
196.9992
XLogP
1.08
TPSA
67.49
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
44.96

Supplementary Information

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