In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 14th, 2013 | 20 | Yes |
Popular Name: Boc-(R)-3-Amino-3-(3-chlorophenyl)proprionic acid Boc-(R)-3-Amino-3-(3-chloropheny…
Find On: PubMed — Wikipedia — Google
CAS Number: [500789-06-0]
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) | 2.59 | 7.31 | -45.81 | 2 | 5 | -1 | 92 | 298.746 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.59 | 6.98 | -33.62 | 3 | 5 | 0 | 94 | 299.754 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.