In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 18 | Yes |
Popular Name: (2S)-2-[3-[ethyl(2-hydroxyethyl)amino]propanoylamino]-3-methyl-butanoic (2S)-2-[3-[ethyl(2-hydroxyethyl)…
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) | -1.64 | 2.26 | -66.59 | 3 | 6 | 0 | 94 | 260.334 | 9 | ↓ |
Hi High (pH 8-9.5) | -1.64 | -0.06 | -57.12 | 2 | 6 | -1 | 93 | 259.326 | 9 | ↓ |