In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: (3R)-3-[[(2R)-2-methylbutyl]amino]-3-(2-thienyl)propanoic (3R)-3-[[(2R)-2-methylbutyl]amin…
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) | 2.72 | 7.78 | -29.23 | 2 | 3 | 0 | 57 | 241.356 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 6.38 | -44.22 | 1 | 3 | -1 | 52 | 240.348 | 7 | ↓ |