In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 14 | Yes |
Popular Name: (2S)-1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]propan-2-amine (2S)-1-[(4aR,8aS)-3,4,4a,5,6,7,8…
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) | 1.72 | 5.83 | -116.58 | 4 | 2 | 2 | 32 | 198.354 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.72 | 5.44 | -27 | 3 | 2 | 1 | 30 | 197.346 | 2 | ↓ |