In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 1st, 2009 | 20 | No |
Popular Name: (NZ)-N-(3-methyl-1,3-benzothiazol-2-ylidene)-2-thioxo-1H-pyridine-3-carboxamide (NZ)-N-(3-methyl-1,3-benzothiazo…
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) | 3.10 | 8.12 | -25.99 | 1 | 4 | 0 | 50 | 301.396 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.83 | 6.73 | -64.39 | 0 | 4 | -1 | 47 | 300.388 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.83 | 6.33 | -60.56 | 0 | 4 | -1 | 47 | 300.388 | 1 | ↓ |