In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 22 | No |
Popular Name: (4S)-4-(4-hydroxyphenyl)-3-methyl-6,7,8,9-tetrahydro-4H-isoxazolo[5,4-b]quinolin-5-one (4S)-4-(4-hydroxyphenyl)-3-methy…
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) | 2.14 | 4.46 | -13.9 | 2 | 5 | 0 | 75 | 296.326 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.68 | 2.52 | -39.23 | 1 | 5 | -1 | 82 | 295.318 | 1 | ↓ |