In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 2nd, 2006 | 24 | Yes |
Popular Name: N-[1-(2,4-dichlorophenyl)ethyl]-2-[(5-hydroxy-4-propyl-1,2,4-triazol-3-yl)sulfanyl]acetamide N-[1-(2,4-dichlorophenyl)ethyl]-…
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) | 3.25 | 6.61 | -19.19 | 2 | 6 | 0 | 80 | 389.308 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.71 | 5.82 | -52.29 | 1 | 6 | -1 | 83 | 388.3 | 7 | ↓ |