In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2005 | 14 | Yes |
Popular Name: 4-(2-oxopyrrolidin-1-yl)benzonitrile 4-(2-oxopyrrolidin-1-yl)benzonit…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 167833-93-4 , [167833-93-4]
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) | 1.06 | 6.02 | -11.13 | 0 | 3 | 0 | 44 | 186.214 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 106 - 108 | Enamine Building Blocks |
MP | 106...108 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |