In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2006 | 26 | Yes |
Popular Name: N-(3,5-dichloro-2-pyridyl)-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(3,5-dichloro-2-pyridyl)-2-[[5…
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) | 3.84 | 7.84 | -20.29 | 2 | 7 | 0 | 93 | 410.286 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.84 | 7.68 | -45.63 | 1 | 7 | -1 | 91 | 409.278 | 6 | ↓ |