In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2010 | 20 | No |
Popular Name: N'-(2-nitrophenyl)-2-thioxo-1H-pyridine-3-carbohydrazide N'-(2-nitrophenyl)-2-thioxo-1H-p…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.22 | 5.98 | -46.5 | 3 | 7 | 0 | 103 | 290.304 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.94 | 5.64 | -68.97 | 2 | 7 | -1 | 100 | 289.296 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.