In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 15 | Yes |
Popular Name: (1S,5S)-3,3,5-trimethyl-1-propylamino-cyclohexane-1-carbonitrile (1S,5S)-3,3,5-trimethyl-1-propyl…
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) | 3.40 | 5.16 | -6.99 | 1 | 2 | 0 | 36 | 208.349 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.40 | 6.43 | -49.79 | 2 | 2 | 1 | 40 | 209.357 | 3 | ↓ |