In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 19 | Yes |
Popular Name: 2,2-diethyl-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]-4-oxo-butanoic 2,2-diethyl-4-[[(1S,3R)-3-hydrox…
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) | 1.28 | 4.19 | -57.52 | 2 | 5 | -1 | 89 | 270.349 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.28 | 1.61 | -7.04 | 3 | 5 | 0 | 87 | 271.357 | 6 | ↓ |