이름: 2,3-Dicyano-6-n-propylamino-6-chloropyrazine
SMILES:
CCCNC1(Cl)C=NC(C#N)=C(C#N)N1Molecular Processing
Molecular formula
C9H10ClN5
Molecular weight
223.67
Exact mass
223.0625
XLogP
0.81
TPSA
84
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
56.76
Supplementary Information
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