CNc1ccc(Oc2ccnc(C#N)c2)cc1N
الاسم: 4-(4-methylamino-3-amino-phenoxy)-pyridine-2-carbonitrile
SMILES: CNc1ccc(Oc2ccnc(C#N)c2)cc1N

Molecular Processing

Molecular formula
C13H12N4O
Molecular weight
240.27
Exact mass
240.1011
XLogP
2.37
TPSA
83.96
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
69.43

Supplementary Information

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