| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 11th, 2011 | 23 | Yes |
Popular Name: (2S)-N-[(1R)-1,2-diphenylethyl]-N-methyl-pyrrolidine-2-carboxamide (2S)-N-[(1R)-1,2-diphenylethyl]-…
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) | 3.22 | 9.96 | -39.72 | 2 | 3 | 1 | 37 | 309.433 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.22 | 8.77 | -12.86 | 1 | 3 | 0 | 32 | 308.425 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0278089A2; US5047541 | IBM Patent Data |
