In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2008 | 25 | Yes |
Popular Name: 3-[ethyl-[3-(4-hydroxyphenyl)-3-oxo-propyl]amino]-1-(4-hydroxyphenyl)propan-1-one 3-[ethyl-[3-(4-hydroxyphenyl)-3-…
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) | 2.60 | 4.25 | -17.41 | 2 | 5 | 0 | 78 | 341.407 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.60 | 5.04 | -51.07 | 1 | 5 | -1 | 81 | 340.399 | 9 | ↓ |