In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 27 | Yes |
Popular Name: (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2S)-1-methyl-2-piperidyl]chroman-4-one (2S)-5,7-dihydroxy-2-(4-hydroxyp…
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) | 3.20 | 5.28 | -40.21 | 4 | 6 | 1 | 91 | 370.425 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.20 | 6.27 | -46.02 | 3 | 6 | 0 | 94 | 369.417 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.