In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 18 | No |
Popular Name: 2,2-diethyl-4-[methyl-[(3R)-tetrahydrothiophen-3-yl]amino]-4-oxo-butanoic 2,2-diethyl-4-[methyl-[(3R)-tetr…
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) | 1.65 | 8.38 | -56.61 | 0 | 4 | -1 | 60 | 272.39 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.65 | 5.87 | -6.39 | 1 | 4 | 0 | 58 | 273.398 | 6 | ↓ |