이름: [2-Chloro-6-(4-fluoro-phenyl)-pyrido[3,2-d]pyrimidin-4-yl]-(1-trifluoromethyl-cyclopropyl)-amine
SMILES:
Fc1ccc(-c2ccc3nc(Cl)nc(NC4(C(F)(F)F)CC4)c3n2)cc1Molecular Processing
Molecular formula
C17H11ClF4N4
Molecular weight
382.75
Exact mass
382.0608
XLogP
4.99
TPSA
50.7
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
26
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
89.38
Supplementary Information
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