| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 19 | Yes |
Popular Name: (S)-2-Amino-N-(2-cyano-benzyl)-N-ethyl-3-methyl-butyramide (S)-2-Amino-N-(2-cyano-benzyl)-N…
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CAS Number: 1306109-05-6
| 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) | 1.13 | 6.11 | -43.4 | 3 | 4 | 1 | 72 | 260.361 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.13 | 5.78 | -14.09 | 2 | 4 | 0 | 70 | 259.353 | 5 | ↓ |
