In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 16 | Yes |
Popular Name: (1S,2S)-2-(dicyclopropylmethylamino)cyclohexanecarbonitrile (1S,2S)-2-(dicyclopropylmethylam…
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) | 3.38 | 8.04 | -36.96 | 2 | 2 | 1 | 40 | 219.352 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 7.43 | -3.66 | 1 | 2 | 0 | 36 | 218.344 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.