In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2007 | 30 | Yes |
Popular Name: 2-chloro-N-[2-methyl-1-(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)-propyl]-benzamide 2-chloro-N-[2-methyl-1-(4-methyl…
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) | 4.16 | 11.65 | -13.03 | 1 | 6 | 0 | 77 | 442.972 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.22 | 10.85 | -36.51 | 2 | 6 | 1 | 82 | 443.98 | 8 | ↓ |