| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2005 | 21 | Yes |
Popular Name: 7,7-dimethyl-1-(((2-pyridylamino)sulfonyl)methyl)bicyclo[2.2.1]heptan-2-one 7,7-dimethyl-1-(((2-pyridylamino…
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CAS Number: 515866-34-9
| 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) | 1.75 | 6.75 | -20.67 | 1 | 5 | 0 | 79 | 308.403 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.57 | 6.49 | -55.31 | 0 | 5 | -1 | 78 | 307.395 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.57 | 6.73 | -43.35 | 2 | 5 | 1 | 77 | 309.411 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.