| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 27 | Yes |
Popular Name: 7-[(4-methylpiperazin-1-yl)methyl]-3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-ol 7-[(4-methylpiperazin-1-yl)methy…
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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) | 3.34 | 6.1 | -38.87 | 2 | 5 | 1 | 54 | 378.374 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 4.48 | -38.4 | 0 | 5 | -1 | 56 | 376.358 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 3.73 | -8.33 | 1 | 5 | 0 | 53 | 377.366 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 6.86 | -46.29 | 1 | 5 | 0 | 57 | 377.366 | 3 | ↓ |
