الاسم: compound 5
SMILES:
Cc1cccc(C)c1NC(=O)CN1CCNCC1Molecular Processing
Molecular formula
C14H21N3O
Molecular weight
247.34
Exact mass
247.1685
XLogP
1.15
TPSA
44.37
H-bond donors
2
H-bond acceptors
3
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
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
73.86
Supplementary Information
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