| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 36 | No |
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CAS Number: [3251-84-1]
| 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) | 4.90 | 17.4 | -19.28 | 1 | 3 | 1 | 18 | 476.688 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.90 | 18.17 | -43.08 | 2 | 3 | 0 | 19 | 477.696 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.90 | 17.65 | -76.8 | 2 | 3 | 2 | 23 | 477.696 | 5 | ↓ |
