SMILES:
CCCn1c(=S)nc(NC2CCCC2)c2[nH]c(C3CC3)nc21Molecular Processing
Molecular formula
C16H23N5S
Molecular weight
317.46
Exact mass
317.1674
XLogP
4.13
TPSA
58.53
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
22
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.688
Molar refractivity
90.86
Supplementary Information
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