| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 32 | Yes |
Popular Name: 7-[[(2S)-2-(3-pyridyl)-1-piperidyl]methyl]-3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-ol 7-[[(2S)-2-(3-pyridyl)-1-piperid…
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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) | 4.70 | 10.31 | -39.3 | 2 | 5 | 1 | 64 | 440.445 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.70 | 9.1 | -41.5 | 0 | 5 | -1 | 65 | 438.429 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.70 | 10.99 | -26.5 | 1 | 5 | 0 | 66 | 439.437 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.70 | 8.46 | -8.57 | 1 | 5 | 0 | 62 | 439.437 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![3-phenyl-7-[[2-(3-pyridyl)piperidino]methyl]indoxazene](http://zinc12.docking.org/img/rings/549868.gif)