| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 30th, 2011 | 14 | Yes |
Popular Name: (S)-3-(N-Bocmethylamino)pyrrolidine (S)-3-(N-Bocmethylamino)pyrrolidine
Find On: PubMed — Wikipedia — Google
CAS Number: 169750-01-0
| 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) | 1.05 | 2.73 | -39.88 | 3 | 4 | 1 | 55 | 201.29 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 1.31 | -4.97 | 2 | 4 | 0 | 50 | 200.282 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0393400A1; EP0393400B1; EP0470578A1; EP0470578B1; EP0596126A1; EP0700912A1; US5245037; US5254685; US5399553; US5407932; US5412098 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.