In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 20 | Yes |
Popular Name: (2S)-4-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-isopropyl-2-methyl-4-oxo-butanoic (2S)-4-[[(1S,2R,3R)-2,3-dimethyl…
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) | 3.06 | 8.17 | -57.48 | 1 | 4 | -1 | 69 | 282.404 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.06 | 6.23 | -12.44 | 2 | 4 | 0 | 66 | 283.412 | 5 | ↓ |