In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2004 | 12 | Yes |
Popular Name: 3-Amino-3-(4-bromo-thiophen-2-yl)-propionic acid 3-Amino-3-(4-bromo-thiophen-2-yl…
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CAS Number: 194229-25-9
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) | -0.42 | 2.75 | -41.6 | 3 | 3 | 0 | 68 | 250.117 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.42 | 2.43 | -40.85 | 2 | 3 | -1 | 66 | 249.109 | 3 | ↓ |