| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2013 | 28 | No |
Popular Name: (E)-N-methyl-2-(3-(2-(pyridin-2-yl)vinyl)-1H-indazol-6-ylthio)benzamide (E)-N-methyl-2-(3-(2-(pyridin-2-…
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CAS Number: 319460-85-0
| 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) | 4.02 | 8.25 | -38.4 | 2 | 5 | 1 | 68 | 387.488 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.02 | 7.63 | -15.78 | 1 | 5 | 0 | 67 | 386.48 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 4.02 | 8.57 | -98.39 | 3 | 5 | 2 | 70 | 388.496 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.