| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 12th, 2008 | 18 | No |
Popular Name: 2-(3-pyridinylmethyl)hexahydro-1H-isoindole-1,3(2H)-dione 2-(3-pyridinylmethyl)hexahydro-1…
| 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) | 1.16 | 6.06 | -7.57 | 0 | 4 | 0 | 50 | 244.294 | 2 | ↓ |
| Ref Reference (pH 7) | 1.16 | 6.06 | -7.32 | 0 | 4 | 0 | 50 | 244.294 | 2 | ↓ |
| Ref Reference (pH 7) | 1.16 | 6.13 | -7.98 | 0 | 4 | 0 | 50 | 244.294 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.16 | 6.41 | -33.11 | 1 | 4 | 1 | 52 | 245.302 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
