| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2005 | 23 | Yes |
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CAS Number: 866134-70-5
| 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) | 4.92 | 9.12 | -34.79 | 1 | 3 | 1 | 41 | 347.269 | 1 | ↓ |
| Mid Mid (pH 6-8) | 4.55 | 8.54 | -41.84 | 1 | 3 | 1 | 41 | 347.269 | 1 | ↓ |
| Mid Mid (pH 6-8) | 4.55 | 9.79 | -35.71 | 1 | 3 | 1 | 41 | 347.269 | 1 | ↓ |
| Mid Mid (pH 6-8) | 4.37 | 9.12 | -46.01 | 1 | 3 | 1 | 41 | 347.269 | 1 | ↓ |
