In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 17 | Yes |
Popular Name: 2-[[4-ethyl-5-[methyl(propyl)amino]-1,2,4-triazol-3-yl]sulfanyl]acetic 2-[[4-ethyl-5-[methyl(propyl)ami…
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) | 1.30 | 9.6 | -47.28 | 0 | 6 | -1 | 74 | 257.339 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.30 | 9.76 | -34.92 | 1 | 6 | 0 | 75 | 258.347 | 7 | ↓ |