In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2007 | 32 | No |
Popular Name: 3-hydroxy-1-(3-morpholinopropyl)-5-(3-nitrophenyl)-4-(2-thienylcarbonyl)-5H-pyrrol-2-one 3-hydroxy-1-(3-morpholinopropyl)…
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) | 2.36 | 9.32 | -56.75 | 2 | 9 | 1 | 117 | 458.516 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 10.03 | -64.52 | 1 | 9 | 1 | 114 | 458.516 | 8 | ↓ |