In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 29 | Yes |
Popular Name: 7-[(dibutylamino)methyl]-3-(3,4,5-trifluorophenyl)-1,2-benzoxazol-6-ol 7-[(dibutylamino)methyl]-3-(3,4,…
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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) | 6.32 | 11.28 | -40.58 | 2 | 4 | 1 | 51 | 407.456 | 9 | ↓ |
Mid Mid (pH 6-8) | 6.32 | 11.94 | -21.59 | 1 | 4 | 0 | 54 | 406.448 | 9 | ↓ |