SMILES:
N#Cc1cnc2cc3c(cc2c1Nc1ccc(F)c(Cl)c1)NCCO3Molecular Processing
Molecular formula
C18H12ClFN4O
Molecular weight
354.77
Exact mass
354.0684
XLogP
4.45
TPSA
69.97
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
25
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
95.14
Supplementary Information
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