| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 12th, 2014 | 24 | Yes |
Popular Name: methyl (2S)-2-[[4-(2-cyanophenyl)phenyl]methylamino]-3-methylbutanoate;hydrochloride methyl (2S)-2-[[4-(2-cyanophenyl…
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CAS Number: 482577-59-3
| 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) | 4.51 | 11.93 | -10.86 | 0 | 4 | 0 | 53 | 322.408 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.