In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2010 | 20 | Yes |
Popular Name: N-[3-chloro-2-(dimethylamino)phenyl]-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide N-[3-chloro-2-(dimethylamino)phe…
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) | 1.80 | 6.84 | -8.88 | 2 | 6 | 0 | 74 | 311.798 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.80 | 6.64 | -39.18 | 1 | 6 | -1 | 72 | 310.79 | 5 | ↓ |