In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 19 | No |
Popular Name: (E)-1-(3-bromophenyl)-3-(3-chloro-4-hydroxy-phenyl)prop-2-en-1-one (E)-1-(3-bromophenyl)-3-(3-chlor…
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) | 4.98 | 7.57 | -7.87 | 1 | 2 | 0 | 37 | 337.6 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.98 | 8.35 | -39.58 | 0 | 2 | -1 | 40 | 336.592 | 3 | ↓ |