In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2006 | 23 | Yes |
Popular Name: 2-[[5-(4-methoxyphenyl)-2H-1,2,4-triazol-3-yl]sulfanyl]-1-morpholino-ethanone 2-[[5-(4-methoxyphenyl)-2H-1,2,4…
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) | 1.68 | 4.94 | -11.48 | 1 | 7 | 0 | 80 | 334.401 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.68 | 4.74 | -45.62 | 0 | 7 | -1 | 79 | 333.393 | 5 | ↓ |