In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 18 | Yes |
Popular Name: 2-[(2S)-1-(p-tolylsulfonyl)pyrrolidin-2-yl]acetonitrile 2-[(2S)-1-(p-tolylsulfonyl)pyrro…
None
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) | 1.55 | 5.67 | -17.44 | 0 | 4 | 0 | 61 | 264.35 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0987266A1 | IBM Patent Data |