In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 20th, 2011 | 26 | Yes |
Popular Name: 1-(2,4-dichlorophenyl)-2-[[4-ethyl-5-(morpholinomethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone 1-(2,4-dichlorophenyl)-2-[[4-eth…
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) | 2.94 | 8.55 | -11.88 | 0 | 6 | 0 | 60 | 415.346 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.94 | 10.73 | -47.97 | 1 | 6 | 1 | 61 | 416.354 | 7 | ↓ |