In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2007 | 25 | Yes |
Popular Name: N-isopropyl-2-[2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino-acetamide N-isopropyl-2-[2-[[5-(4-methoxyp…
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) | 1.87 | 3.48 | -12.88 | 3 | 8 | 0 | 109 | 363.443 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.87 | 3.28 | -48.84 | 2 | 8 | -1 | 107 | 362.435 | 8 | ↓ |