In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 17 | Yes |
Popular Name: 2-[[(1S,2S)-2-methylcyclohexyl]amino]-1-(1-piperidyl)ethanone 2-[[(1S,2S)-2-methylcyclohexyl]a…
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) | 2.50 | 7.03 | -38.77 | 2 | 3 | 1 | 37 | 239.383 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 5.77 | -6.61 | 1 | 3 | 0 | 32 | 238.375 | 3 | ↓ |