In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: 4-[[(1R)-2-methyl-1-(2-thienyl)propyl]amino]-4-oxo-butanoic 4-[[(1R)-2-methyl-1-(2-thienyl)p…
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) | 1.81 | 6.4 | -44.65 | 1 | 4 | -1 | 69 | 254.331 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.81 | 4.31 | -7.39 | 2 | 4 | 0 | 66 | 255.339 | 6 | ↓ |