In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 29 | Yes |
Popular Name: 3-(4-bromophenyl)-8-(diethylaminomethyl)-7-hydroxy-2-(trifluoromethyl)chromen-4-one 3-(4-bromophenyl)-8-(diethylamin…
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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) | 5.93 | 10.51 | -41.63 | 2 | 4 | 1 | 55 | 471.293 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.93 | 11.17 | -24.23 | 1 | 4 | 0 | 58 | 470.285 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.93 | 8.18 | -6.01 | 1 | 4 | 0 | 54 | 470.285 | 6 | ↓ |