In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2007 | 27 | No |
Popular Name: 1-allyl-3-hydroxy-5-(4-methoxyphenyl)-4-(4-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one 1-allyl-3-hydroxy-5-(4-methoxyph…
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) | 3.53 | 8.71 | -60.79 | 0 | 5 | -1 | 70 | 362.405 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 8.67 | -11.57 | 1 | 5 | 0 | 67 | 363.413 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.94 | 9.02 | -11.47 | 0 | 5 | 0 | 64 | 363.413 | 6 | ↓ |