In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2007 | 30 | No |
Popular Name: 4-(1-hydroxy-3-phenyl-prop-2-enylidene)-1-(m-tolyl)-5-phenyl-pyrrolidine-2,3-dione 4-(1-hydroxy-3-phenyl-prop-2-eny…
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) | 4.87 | 13.33 | -63.97 | 0 | 4 | -1 | 60 | 394.45 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.87 | 12.55 | -12.37 | 1 | 4 | 0 | 58 | 395.458 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.29 | 13 | -9.86 | 0 | 4 | 0 | 54 | 395.458 | 5 | ↓ |