In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2012 | 16 | No |
Popular Name: Boc-2-aminocyclopentanecarboxylic acid Boc-2-aminocyclopentanecarboxyli…
Find On: PubMed — Wikipedia — Google
CAS Number: 192385-99-2
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) | 0.45 | 4.75 | -32.68 | 3 | 5 | 0 | 94 | 229.276 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.45 | 4.49 | -47.42 | 2 | 5 | -1 | 92 | 228.268 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0417454A3 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.