| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 20 | No |
Popular Name: 2-[(3-chloroanilino)methyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione 2-[(3-chloroanilino)methyl]-3a,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) | 2.63 | 6.91 | -6.38 | 1 | 4 | 0 | 49 | 290.75 | 3 | ↓ |
| Ref Reference (pH 7) | 2.63 | 6.9 | -6.41 | 1 | 4 | 0 | 49 | 290.75 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
