In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2006 | 28 | No |
Popular Name: 1-[5-(4-dimethylaminophenyl)-3-(1-hydroxy-2-naphthyl)-4,5-dihydropyrazol-1-yl]ethanone 1-[5-(4-dimethylaminophenyl)-3-(…
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) | 3.92 | 9.49 | -12.42 | 1 | 5 | 0 | 56 | 373.456 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.92 | 10.22 | -48.04 | 0 | 5 | -1 | 59 | 372.448 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.92 | 10.25 | -67.21 | 2 | 5 | 0 | 57 | 374.464 | 3 | ↓ |