| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2009 | 8 | Yes |
Popular Name: Pyrrolo[3,4-b]pyrrole, octahydro-, hydrochloride (1:2) Pyrrolo[3,4-b]pyrrole, octahydro…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 479070-13-8 , 931-00-0
| 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) | 0.23 | -0.48 | -36.8 | 3 | 2 | 1 | 29 | 113.184 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.23 | 0.88 | -102.66 | 4 | 2 | 2 | 33 | 114.192 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.23 | -0.58 | -35.14 | 3 | 2 | 1 | 29 | 113.184 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.