In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 25 | Yes |
Popular Name: N-(1-phenethyl-4-piperidyl)-2,3,3a,4,5,6-hexahydro-1H-pyrrolo[3,4-c]pyrrole-6a-carboxamide N-(1-phenethyl-4-piperidyl)-2,3,…
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) | 1.71 | 5.19 | -101.33 | 5 | 5 | 2 | 62 | 344.503 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.71 | 6.63 | -185.93 | 6 | 5 | 3 | 67 | 345.511 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.