| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 13 | Yes |
Popular Name: 3-(Trifluoromethyl)-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine 3-(Trifluoromethyl)-4,5,6,7-tetr…
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CAS Numbers: 853784-21-1 , [853784-21-1]
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| 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) | 1.22 | 1.98 | -45.63 | 3 | 3 | 1 | 45 | 192.164 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 0.35 | -33.62 | 1 | 3 | -1 | 39 | 190.148 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 1.72 | -44.62 | 2 | 3 | 0 | 44 | 191.156 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.22 | 1.86 | -52.65 | 3 | 3 | 1 | 45 | 192.164 | 1 | ↓ |
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