In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2004 | 29 | Yes |
Popular Name: N-[[4-allyl-5-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]methyl]benzamide N-[[4-allyl-5-[[2-(4-bromophenyl…
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) | 3.68 | -0.48 | -12.55 | 1 | 6 | 0 | 76 | 471.38 | 9 | ↓ |