In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2010 | 23 | Yes |
Popular Name: (2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-4-hydroxy-4-oxo-butanoyl]amino]pentanedioic (2S)-2-[[(2S)-2-[[(2S)-2-aminopr…
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) | -4.79 | 1.57 | -163.06 | 5 | 11 | -2 | 206 | 331.281 | 10 | ↓ |
Hi High (pH 8-9.5) | -4.79 | 1.16 | -179.79 | 4 | 11 | -3 | 205 | 330.273 | 10 | ↓ |
Lo Low (pH 4.5-6) | -4.79 | -0.4 | -119.14 | 6 | 11 | -1 | 203 | 332.289 | 10 | ↓ |