Cc1cc(C(=O)O)sc1CC[C@H]1CNc2nc(N)[nH]c(=O)c2C1
SMILES: Cc1cc(C(=O)O)sc1CC[C@H]1CNc2nc(N)[nH]c(=O)c2C1

Molecular Processing

Molecular formula
C15H18N4O3S
Molecular weight
334.4
Exact mass
334.11
XLogP
1.64
TPSA
121.1
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
89.29

Supplementary Information

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