In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 16 | No |
Popular Name: 3-Amino-3-(4-fluoro-3-nitrophenyl)propanoic acid 3-Amino-3-(4-fluoro-3-nitropheny…
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CAS Number: 773126-10-6
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) | -1.01 | 4.76 | -50.5 | 3 | 6 | 0 | 114 | 228.179 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.01 | 4.43 | -41.77 | 2 | 6 | -1 | 112 | 227.171 | 4 | ↓ |