In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 28 | Yes |
Popular Name: 3-(4-bromophenyl)-7-hydroxy-2-methyl-8-[[(3R)-3-methyl-1-piperidyl]methyl]chromen-4-one 3-(4-bromophenyl)-7-hydroxy-2-me…
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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) | 5.42 | 11.17 | -46.79 | 2 | 4 | 1 | 55 | 443.361 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.42 | 11.93 | -32.39 | 1 | 4 | 0 | 58 | 442.353 | 3 | ↓ |