In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2004 | 24 | Yes |
Popular Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-thiazol-2-yl-acetamide 2-[(5-benzyl-4-ethyl-1,2,4-triaz…
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) | 2.68 | 9.69 | -17.94 | 1 | 6 | 0 | 73 | 359.48 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.86 | 8.47 | -48.71 | 0 | 6 | -1 | 79 | 358.472 | 7 | ↓ |