In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 18th, 2006 | 24 | Yes |
Popular Name: N-(4-bromophenyl)-2-[[5-(m-tolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide N-(4-bromophenyl)-2-[[5-(m-tolyl…
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) | 4.46 | 9.03 | -21.57 | 2 | 5 | 0 | 71 | 403.305 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.46 | 8.87 | -47.35 | 1 | 5 | -1 | 69 | 402.297 | 5 | ↓ |