In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2008 | 22 | Yes |
Popular Name: N-(4-bromo-2-chloro-phenyl)-2-[(5-tert-butyl-1H-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) | 4.34 | 7.64 | -15.55 | 2 | 5 | 0 | 71 | 403.733 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.34 | 7.49 | -40.67 | 1 | 5 | -1 | 69 | 402.725 | 5 | ↓ |