In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: 4-[[(1R)-1-(3-acetamidophenyl)ethyl]amino]-4-oxo-butanoic 4-[[(1R)-1-(3-acetamidophenyl)et…
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) | 0.36 | 4.73 | -50.71 | 2 | 6 | -1 | 98 | 277.3 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.36 | 2.77 | -14.43 | 3 | 6 | 0 | 95 | 278.308 | 6 | ↓ |