In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2010 | 12 | Yes |
Popular Name: (3R,9aS)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine-3-carbonitrile (3R,9aS)-2,3,4,6,7,8,9,9a-octahy…
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) | 1.80 | 6.54 | -38.67 | 1 | 2 | 1 | 28 | 165.26 | 0 | ↓ |
Hi High (pH 8-9.5) | 1.80 | 4.51 | -7.25 | 0 | 2 | 0 | 27 | 164.252 | 0 | ↓ |