CCCCc1nc2c(N)nc3ccccc3c2n1CCNS(C)(=O)=O
SMILES: CCCCc1nc2c(N)nc3ccccc3c2n1CCNS(C)(=O)=O

Molecular Processing

Molecular formula
C17H23N5O2S
Molecular weight
361.47
Exact mass
361.1572
XLogP
2.06
TPSA
102.9
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
25
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
100.9

Supplementary Information

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