名称: 1,1-Dimethylethyl (2S)-2-{[(5-amino-4-pyrimidinyl)amino]methyl}-1-pyrrolidinecarboxylate
SMILES:
CC(C)(C)OC(=O)N1CCC[C@H]1CNc1ncncc1NMolecular Processing
Molecular formula
C14H23N5O2
Molecular weight
293.37
Exact mass
293.1852
XLogP
1.87
TPSA
93.37
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.643
Molar refractivity
80.9
Supplementary Information
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