| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 7th, 2010 | 21 | Yes |
Popular Name: (1S,8aR)-1-cyclohexyl-2-(2-thienylmethyl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine (1S,8aR)-1-cyclohexyl-2-(2-thien…
| 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) | 4.20 | 11.31 | -108.3 | 2 | 2 | 2 | 9 | 306.519 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.20 | 9.31 | -1.7 | 0 | 2 | 0 | 6 | 304.503 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.20 | 9.42 | -32.98 | 1 | 2 | 1 | 8 | 305.511 | 3 | ↓ |
