| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 21 | Yes |
Popular Name: (2S)-2-(cyclopropylamino)-3-[3-methoxypropyl(methyl)amino]-2-phenyl-propanenitrile (2S)-2-(cyclopropylamino)-3-[3-m…
| 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) | 2.19 | 7.7 | -39.25 | 2 | 4 | 1 | 49 | 288.415 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.19 | 5.6 | -7.07 | 1 | 4 | 0 | 48 | 287.407 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
