이름: Compound ( 38 )
SMILES:
COC(=O)c1ncc(NC2CCNCC2)nc1NMolecular Processing
Molecular formula
C11H17N5O2
Molecular weight
251.29
Exact mass
251.1382
XLogP
0.01
TPSA
102.16
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.545
Molar refractivity
67.3
Supplementary Information
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