In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 18th, 2006 | 27 | No |
Popular Name: 3-hydroxy-5-(4-methoxyphenyl)-1-(3-methoxypropyl)-4-(2-thienylcarbonyl)-5H-pyrrol-2-one 3-hydroxy-5-(4-methoxyphenyl)-1-…
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) | 2.59 | 6.75 | -60.09 | 0 | 6 | -1 | 79 | 386.449 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.04 | 5.72 | -28.62 | 1 | 6 | 0 | 76 | 387.457 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.01 | 6.69 | -20.14 | 0 | 6 | 0 | 73 | 387.457 | 8 | ↓ |