| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2012 | 19 | No |
Popular Name: (S)-1-((R)-1-cyclohexyl-2-(methylamino)-2-oxoethyl)pyrrolidine-2-carboxylic acid (S)-1-((R)-1-cyclohexyl-2-(methy…
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CAS Number: 1421051-44-6
| 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) | -0.10 | 6.78 | -48.77 | 2 | 5 | 0 | 74 | 268.357 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.10 | 5.4 | -65.35 | 1 | 5 | -1 | 72 | 267.349 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.