In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 13 | Yes |
Popular Name: (1S,3R)-3-methyl-1-(propylamino)cyclohexanecarbonitrile (1S,3R)-3-methyl-1-(propylamino)…
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) | 2.74 | 4.49 | -6.11 | 1 | 2 | 0 | 36 | 180.295 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 5.7 | -44.98 | 2 | 2 | 1 | 40 | 181.303 | 3 | ↓ |