| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2011 | 23 | Yes |
Popular Name: N,N-bis(2-cyanoethyl)-2-[(2R)-2-cyclohexylpyrrolidin-1-yl]acetamide N,N-bis(2-cyanoethyl)-2-[(2R)-2-…
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| 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) | 1.29 | 10.94 | -55.39 | 1 | 5 | 1 | 72 | 317.457 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.29 | 9.22 | -16.95 | 0 | 5 | 0 | 71 | 316.449 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
