| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 22 | No |
Popular Name: Boc-(R)-3-amino-4-(3-cyanophenyl)-butyricacid Boc-(R)-3-amino-4-(3-cyanophenyl…
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CAS Number: 269726-83-2
| 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) | 1.38 | 7.82 | -48.06 | 3 | 6 | 0 | 118 | 304.346 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 7.53 | -44.47 | 2 | 6 | -1 | 116 | 303.338 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.