In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2010 | 14 | Yes |
Popular Name: (3aS,6aS)-2-cyclohexyl-3,3a,4,5,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole (3aS,6aS)-2-cyclohexyl-3,3a,4,5,…
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) | 2.50 | 3.7 | -38.59 | 2 | 2 | 1 | 20 | 195.33 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.50 | 6.12 | -99.41 | 3 | 2 | 2 | 21 | 196.338 | 1 | ↓ |