| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 21 | Yes |
| 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) | 2.04 | 10.45 | -76.36 | 1 | 5 | 0 | 61 | 307.419 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.04 | 8.86 | -54.29 | 0 | 5 | -1 | 59 | 306.411 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.04 | 10.77 | -90.07 | 2 | 5 | 1 | 62 | 308.427 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
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