In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 2nd, 2006 | 19 | No |
Popular Name: 4-Ethyl-5-(2-isopropyl-phenoxymethyl)-4H-[1,2,4]triazole-3-thiol 4-Ethyl-5-(2-isopropyl-phenoxyme…
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) | 3.30 | 9.46 | -46.48 | 0 | 4 | -1 | 40 | 276.385 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.57 | 9.54 | -13.76 | 1 | 4 | 0 | 43 | 277.393 | 5 | ↓ |