SMILES:
N#Cc1cnc(Nc2cc3cc(Cl)ccc3cn2)cn1Molecular Processing
Molecular formula
C14H8ClN5
Molecular weight
281.71
Exact mass
281.0468
XLogP
3.29
TPSA
74.49
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
3
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
76.78
Supplementary Information
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