In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2011 | 23 | Yes |
Popular Name: (3,6-dimethylisoxazolo[5,4-b]pyridin-4-yl)-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]methanone (3,6-dimethylisoxazolo[5,4-b]pyr…
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) | 0.01 | -0.14 | -13.08 | 1 | 7 | 0 | 83 | 318.377 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.01 | 2.04 | -54.67 | 2 | 7 | 1 | 84 | 319.385 | 3 | ↓ |