In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 9th, 2008 | 14 | No |
Popular Name: (2R)-2-amino-3-[(2S)-2-amino-3-hydroxy-3-oxo-propyl]disulfanyl-propanoic (2R)-2-amino-3-[(2S)-2-amino-3-h…
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) | -4.86 | 2.13 | -66.64 | 6 | 6 | 0 | 136 | 240.306 | 7 | ↓ |
Hi High (pH 8-9.5) | -4.86 | 1.5 | -91.57 | 4 | 6 | -2 | 132 | 238.29 | 7 | ↓ |
Hi High (pH 8-9.5) | -4.86 | 1.82 | -72.1 | 5 | 6 | -1 | 134 | 239.298 | 7 | ↓ |