In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2011 | 19 | No |
Popular Name: (2S)-2-[[(2R)-2-aminohexanoyl]-[(1S)-2-hydroxy-1-methyl-2-oxo-ethyl]amino]propanoic (2S)-2-[[(2R)-2-aminohexanoyl]-[…
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) | -3.29 | 5.61 | -120.41 | 3 | 7 | -1 | 128 | 273.309 | 8 | ↓ |
Hi High (pH 8-9.5) | -3.29 | 5.21 | -126.94 | 2 | 7 | -2 | 127 | 272.301 | 8 | ↓ |