| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 14 | Yes |
Popular Name: [(1S,3S)-1-(but-2-ynylamino)-3-methyl-cyclohexyl]methanol [(1S,3S)-1-(but-2-ynylamino)-3-m…
| 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) | 2.42 | 4.13 | -7.62 | 3 | 2 | 0 | 37 | 196.314 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 3.3 | -3.7 | 2 | 2 | 0 | 32 | 195.306 | 3 | ↓ |
