In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 30 | Yes |
Popular Name: 5-hydroxy-3-(4-hydroxyphenyl)-7-(4-piperazin-1-ylbutoxy)chromen-4-one 5-hydroxy-3-(4-hydroxyphenyl)-7-…
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) | 2.67 | 4.27 | -49.18 | 4 | 7 | 1 | 100 | 411.478 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | 6.52 | -128.25 | 5 | 7 | 2 | 101 | 412.486 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.67 | 5.19 | -47.29 | 4 | 7 | 1 | 96 | 411.478 | 7 | ↓ |