In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2006 | 27 | No |
Popular Name: 1-allyl-4-benzoyl-3-hydroxy-5-(4-isopropylphenyl)-1,5-dihydro-2H-pyrrol-2-one 1-allyl-4-benzoyl-3-hydroxy-5-(4…
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) | 4.53 | 10.72 | -61.48 | 0 | 4 | -1 | 60 | 360.433 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.98 | 1.83 | -18.03 | 1 | 4 | 0 | 57 | 361.441 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.95 | 1.57 | -10.03 | 0 | 4 | 0 | 54 | 361.441 | 6 | ↓ |