In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 14th, 2014 | 18 | No |
Popular Name: (1r,2s)-boc-2-aminocyclo-heptanecarboxylicacid (1r,2s)-boc-2-aminocyclo-heptane…
Find On: PubMed — Wikipedia — Google
CAS Number: 1212407-62-9
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) | 1.46 | 5.7 | -44.6 | 3 | 5 | 0 | 94 | 257.33 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.46 | 5.39 | -49.5 | 2 | 5 | -1 | 92 | 256.322 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.