In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2008 | 32 | No |
Popular Name: (5S)-4-(4-ethoxybenzoyl)-3-hydroxy-5-(4-isopropylphenyl)-1-(3-methoxypropyl)-5H-pyrrol-2-one (5S)-4-(4-ethoxybenzoyl)-3-hydro…
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) | 4.58 | 10.05 | -61.8 | 0 | 6 | -1 | 79 | 436.528 | 10 | ↓ |
Mid Mid (pH 6-8) | 5.02 | 9.41 | -27.37 | 1 | 6 | 0 | 76 | 437.536 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.99 | 10.43 | -18.87 | 0 | 6 | 0 | 73 | 437.536 | 10 | ↓ |