In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2011 | 11 | Yes |
Popular Name: 3-Amino-1-piperidin-4-yl-propan-1-onehydrochloride 3-Amino-1-piperidin-4-yl-propan-…
Find On: PubMed — Wikipedia — Google
CAS Number: 221043-84-1
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) | -1.24 | 1.1 | -96.53 | 5 | 3 | 2 | 61 | 158.245 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.24 | 0.72 | -43 | 4 | 3 | 1 | 60 | 157.237 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 98% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.