In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 17 | No |
Popular Name: [(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-[(4R)-thiazolidin-4-yl]methanone [(4aR,8aS)-3,4,4a,5,6,7,8,8a-oct…
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) | 1.98 | 5.91 | -38.65 | 2 | 3 | 1 | 37 | 255.407 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 4.85 | -8.35 | 1 | 3 | 0 | 32 | 254.399 | 1 | ↓ |