In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 18 | Yes |
Popular Name: 2-[[(1R,3R)-1-(hydroxymethyl)-3-methyl-cyclohexyl]amino]-N-(2-methoxyethyl)acetamide 2-[[(1R,3R)-1-(hydroxymethyl)-3-…
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) | 1.04 | 0.29 | -34.76 | 4 | 5 | 1 | 75 | 259.37 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.04 | -0.51 | -8.91 | 3 | 5 | 0 | 71 | 258.362 | 7 | ↓ |