In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 29 | No |
Popular Name: (2R)-1-allyl-2-(4-tert-butylphenyl)-3-(4-fluorobenzoyl)-4-hydroxy-2H-pyrrol-5-one (2R)-1-allyl-2-(4-tert-butylphen…
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) | 4.89 | 11.03 | -54.85 | 0 | 4 | -1 | 60 | 392.45 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.89 | 10.27 | -11.33 | 1 | 4 | 0 | 58 | 393.458 | 6 | ↓ |