In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 26 | No |
Popular Name: (5R)-1-(2-diethylaminoethyl)-4-(furan-2-carbonyl)-3-hydroxy-5-(2-thienyl)-5H-pyrrol-2-one (5R)-1-(2-diethylaminoethyl)-4-(…
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) | 2.32 | 8.07 | -68.61 | 1 | 6 | 0 | 78 | 374.462 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 5.77 | -58.33 | 0 | 6 | -1 | 77 | 373.454 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.32 | 7.25 | -47.44 | 2 | 6 | 1 | 75 | 375.47 | 8 | ↓ |