In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 20 | Yes |
Popular Name: (1S,5R)-8-methyl-N-[(1R,3S)-3-(trifluoromethyl)cyclohexyl]-8-azabicyclo[3.2.1]octan-3-amine (1S,5R)-8-methyl-N-[(1R,3S)-3-(t…
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) | 3.36 | 6.59 | -37.52 | 2 | 2 | 1 | 20 | 291.381 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.36 | 9.14 | -31.74 | 2 | 2 | 1 | 16 | 291.381 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.36 | 8.95 | -104.81 | 3 | 2 | 2 | 21 | 292.389 | 3 | ↓ |