| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2006 | 24 | No |
Popular Name: 5-methyl-2-[4-(1-piperidyl)phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione 5-methyl-2-[4-(1-piperidyl)pheny…
| 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) | 3.76 | 10.17 | -6.55 | 0 | 4 | 0 | 41 | 324.424 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.76 | 10.81 | -32.55 | 1 | 4 | 1 | 42 | 325.432 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.76 | 10.81 | -32.56 | 1 | 4 | 1 | 42 | 325.432 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.76 | 10.86 | -33.59 | 1 | 4 | 1 | 42 | 325.432 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.76 | 10.81 | -33.43 | 1 | 4 | 1 | 42 | 325.432 | 2 | ↓ |
