| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2010 | 19 | Yes |
Popular Name: (4-isopentylpiperazin-1-yl)-(5-methylisoxazol-3-yl)methanone (4-isopentylpiperazin-1-yl)-(5-m…
| 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) | 1.86 | 7.23 | -41.65 | 1 | 5 | 1 | 51 | 266.365 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 5.01 | -6.53 | 0 | 5 | 0 | 50 | 265.357 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
