| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2012 | 12 | Yes |
Popular Name: 3-Oxoisoindoline-4-carbonitrile 3-Oxoisoindoline-4-carbonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 129221-89-2 , [129221-89-2]
1H-Isoindole-4-carbonitrile, 2,3-dihydro-3-oxo-
| 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) | 0.42 | 2.31 | -18.26 | 1 | 3 | 0 | 53 | 158.16 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.