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 | -0.27 | -35.07 | 3 | 2 | 1 | 29 | 113.184 | 0 | ↓ |
Lo Low (pH 4.5-6) | 0.23 | 0.98 | -103.69 | 4 | 2 | 2 | 33 | 114.192 | 0 | ↓ |
Lo Low (pH 4.5-6) | 0.23 | -0.45 | -35.32 | 3 | 2 | 1 | 29 | 113.184 | 0 | ↓ |