In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 17th, 2004 | 34 | No |
Popular Name: (5R)-5-(4-chlorophenyl)-1-[2-(1H-indol-3-yl)ethyl]-2-keto-4-p-toluoyl-3-pyrrolin-3-olate (5R)-5-(4-chlorophenyl)-1-[2-(1H…
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) | 5.46 | 13.9 | -45.3 | 1 | 5 | -1 | 76 | 469.948 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.91 | 12.09 | -27.49 | 2 | 5 | 0 | 73 | 470.956 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.88 | 13.12 | -19.84 | 1 | 5 | 0 | 70 | 470.956 | 6 | ↓ |