In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2008 | 20 | Yes |
Popular Name: N-(4-bromo-2-chloro-phenyl)-2-[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(4-bromo-2-chloro-phenyl)-2-[(…
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) | 3.19 | 6.59 | -7.93 | 2 | 5 | 0 | 71 | 375.679 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.19 | 6.39 | -39.86 | 1 | 5 | -1 | 69 | 374.671 | 5 | ↓ |