In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 23 | Yes |
Popular Name: N-(5-isopropyl-4H-1,2,4-triazol-3-yl)-2-[5-methyl-2-(2-thienyl)oxazol-4-yl]acetamide N-(5-isopropyl-4H-1,2,4-triazol-…
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) | 2.29 | 5.98 | -20.64 | 2 | 7 | 0 | 97 | 331.401 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 4.61 | -50.61 | 1 | 7 | -1 | 103 | 330.393 | 5 | ↓ |