In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 12th, 2008 | 23 | No |
Popular Name: 5-methyl-2-[[(5-methyl-4-phenyl-2H-pyrazol-3-yl)amino]methylene]cyclohexane-1,3-dione 5-methyl-2-[[(5-methyl-4-phenyl-…
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) | 2.77 | 8.79 | -40.57 | 1 | 5 | -1 | 81 | 308.361 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.77 | 7.44 | -18.33 | 2 | 5 | 0 | 78 | 309.369 | 3 | ↓ |