In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2008 | 27 | Yes |
Popular Name: N-[[(2R)-1,4-dioxan-2-yl]methyl]-N-methyl-1-[3-(4-phenylphenyl)-1H-pyrazol-4-yl]methanamine N-[[(2R)-1,4-dioxan-2-yl]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) | 3.15 | 10.23 | -43.41 | 2 | 5 | 1 | 52 | 364.469 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.15 | 7.35 | -10.69 | 1 | 5 | 0 | 50 | 363.461 | 6 | ↓ |