| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: 2-(cyclopropylmethylamino)-1-[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]ethanone 2-(cyclopropylmethylamino)-1-[4-…
| 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) | 0.20 | 4.49 | -50.13 | 2 | 6 | 1 | 66 | 293.391 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.20 | 3.12 | -12.85 | 1 | 6 | 0 | 62 | 292.383 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.20 | 6.69 | -112.83 | 3 | 6 | 2 | 67 | 294.399 | 6 | ↓ |
