In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2010 | 16 | Yes |
Popular Name: (4aS,8aS)-1-[[(3R)-pyrrolidin-3-yl]methyl]-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline (4aS,8aS)-1-[[(3R)-pyrrolidin-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) | 2.80 | 7.52 | -99.04 | 3 | 2 | 2 | 21 | 224.392 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.80 | 6.17 | -37.94 | 2 | 2 | 1 | 20 | 223.384 | 2 | ↓ |