| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 9 | Yes |
Popular Name: 1-isopropyl-3-pyrrolidinone hydrochloride 1-isopropyl-3-pyrrolidinone hydr…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1609401-23-1 , 58039-28-4
| 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) | 0.32 | 4.22 | -37.6 | 1 | 2 | 1 | 22 | 128.195 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 1.79 | -3.7 | 0 | 2 | 0 | 20 | 127.187 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.
