| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 14 | No |
Popular Name: Indeno[1,2-c]pyrrole-1,3(2H,3aH)-dione, 8,8a-dihydro- Indeno[1,2-c]pyrrole-1,3(2H,3aH)…
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CAS Number: 4464-94-2
| 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) | 0.56 | 3.15 | -8.38 | 1 | 3 | 0 | 46 | 187.198 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 0.48 | -42.83 | 0 | 3 | -1 | 52 | 186.19 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 1.24 | -40.03 | 0 | 3 | -1 | 52 | 186.19 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 0.6 | -42.7 | 0 | 3 | -1 | 52 | 186.19 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 0.64 | -43.7 | 0 | 3 | -1 | 52 | 186.19 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4,8b-dihydro-3aH-indeno[1,2-c]pyrrole-1,3-quinone](http://zinc12.docking.org/img/rings/469.gif)