In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 22 | No |
Popular Name: (4-ethylpiperazin-1-yl)-[(5R)-3-(2-fluorophenyl)-4,5-dihydroisoxazol-5-yl]methanone (4-ethylpiperazin-1-yl)-[(5R)-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) | 1.66 | 6.39 | -22.45 | 0 | 5 | 0 | 45 | 305.353 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 8.65 | -63.66 | 1 | 5 | 1 | 46 | 306.361 | 3 | ↓ |