In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2007 | 31 | No |
Popular Name: 5-(4-bromophenyl)-3-hydroxy-1-(m-tolyl)-4-(3-phenylprop-2-enoyl)-5H-pyrrol-2-one 5-(4-bromophenyl)-3-hydroxy-1-(m…
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) | 5.68 | 13.65 | -40.11 | 0 | 4 | -1 | 60 | 473.346 | 4 | ↓ |
Ref Reference (pH 7) | 5.68 | 13.95 | -60.29 | 0 | 4 | -1 | 60 | 473.346 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.10 | 13.89 | -22.05 | 0 | 4 | 0 | 54 | 474.354 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.68 | 12.92 | -28.51 | 1 | 4 | 0 | 58 | 474.354 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.68 | 13.05 | -13.74 | 1 | 4 | 0 | 58 | 474.354 | 5 | ↓ |