| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 22 | No |
Popular Name: Boc-(S)-3-amino-4-(2-cyanophenyl)-butyricacid Boc-(S)-3-amino-4-(2-cyanophenyl…
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CAS Number: 270065-83-3
| 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) | 1.35 | 8.06 | -29.19 | 3 | 6 | 0 | 118 | 304.346 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 7.74 | -51.56 | 2 | 6 | -1 | 116 | 303.338 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.