SMILES:
Cc1ccc2c(-c3n[nH]c(=S)n3C)cccc2n1Molecular Processing
Molecular formula
C13H12N4S
Molecular weight
256.33
Exact mass
256.0783
XLogP
3
TPSA
46.5
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
73.87
Supplementary Information
詳細情報を取得中…
15 件の反応に参加→