In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 19 | No |
Popular Name: (2S)-2-amino-3-(4-hydroxy-2,5-dinitro-phenyl)propanoic (2S)-2-amino-3-(4-hydroxy-2,5-di…
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) | -1.68 | 3.12 | -65.75 | 3 | 10 | -1 | 182 | 270.177 | 5 | ↓ |
Lo Low (pH 4.5-6) | -1.68 | 2.18 | -47.58 | 4 | 10 | 0 | 180 | 271.185 | 5 | ↓ |