In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2006 | 28 | Yes |
Popular Name: N-(3,4-diethoxyphenyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(3,4-diethoxyphenyl)-2-[(5-phe…
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) | 3.63 | 8.81 | -24.27 | 2 | 7 | 0 | 89 | 398.488 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.63 | 8.65 | -49.66 | 1 | 7 | -1 | 87 | 397.48 | 9 | ↓ |