In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2010 | 16 | Yes |
Popular Name: 4-Bromo-2-piperazinobenzoic Acid 4-Bromo-2-piperazinobenzoic Acid
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CAS Number: 1197193-25-1
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) | 2.17 | 6.67 | -59.99 | 2 | 4 | 0 | 60 | 285.141 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.17 | 4.97 | -40.99 | 1 | 4 | -1 | 55 | 284.133 | 2 | ↓ |