Name: 2-amino-4-chloro-6-neopentylpyrimidine
SMILES:
CC(C)(C)Cc1cc(Cl)nc(N)n1Molecular Processing
Molecular formula
C9H14ClN3
Molecular weight
199.69
Exact mass
199.0876
XLogP
2.3
TPSA
51.8
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
54.61
Supplementary Information
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