| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 28 | Yes |
Popular Name: 7-[(4-ethylpiperazin-1-yl)methyl]-3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-ol 7-[(4-ethylpiperazin-1-yl)methyl…
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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) | 3.71 | 6.78 | -37.6 | 2 | 5 | 1 | 54 | 392.401 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 5.27 | -38.34 | 0 | 5 | -1 | 56 | 390.385 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 7.55 | -43.98 | 1 | 5 | 0 | 57 | 391.393 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 4.5 | -8.08 | 1 | 5 | 0 | 53 | 391.393 | 4 | ↓ |
