In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 19 | No |
Popular Name: (E)-3-[1,3-dimethyl-5-[methyl(pentyl)amino]pyrazol-4-yl]prop-2-enoic (E)-3-[1,3-dimethyl-5-[methyl(pe…
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) | 2.50 | 8.02 | -58.75 | 1 | 5 | 0 | 62 | 265.357 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 7.89 | -55.02 | 0 | 5 | -1 | 61 | 264.349 | 7 | ↓ |