In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 17 | Yes |
Popular Name: 2-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c]pyrazin-2-yl]-3-chloro-aniline 2-[(8aR)-3,4,6,7,8,8a-hexahydro-…
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) | 2.39 | 5.59 | -31.56 | 3 | 3 | 1 | 34 | 252.769 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.39 | 3.32 | -3.74 | 2 | 3 | 0 | 32 | 251.761 | 1 | ↓ |