In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 5th, 2006 | 29 | No |
Popular Name: 1-(3-dimethylaminopropyl)-5-(4-ethoxyphenyl)-3-hydroxy-4-(2-thienylcarbonyl)-5H-pyrrol-2-one 1-(3-dimethylaminopropyl)-5-(4-e…
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) | 3.01 | 0.16 | -50.38 | 2 | 6 | 1 | 71 | 415.535 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.43 | 0.03 | -59.81 | 1 | 6 | 1 | 68 | 415.535 | 9 | ↓ |