| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 24 | Yes |
Popular Name: (2S)-2-[benzyl(methyl)amino]-N-(2-cyanoethyl)-N-phenyl-propanamide (2S)-2-[benzyl(methyl)amino]-N-(…
| 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) | 2.58 | 11.37 | -47.26 | 1 | 4 | 1 | 49 | 322.432 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 8.89 | -12.2 | 0 | 4 | 0 | 47 | 321.424 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
