| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2010 | 19 | Yes |
Popular Name: (2S)-2-(ethylamino)-2-phenyl-3-(1,3,4-thiadiazol-2-ylsulfanyl)propanenitrile (2S)-2-(ethylamino)-2-phenyl-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) | 2.85 | 5.08 | -9.27 | 1 | 4 | 0 | 62 | 290.417 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.85 | 6.08 | -44.48 | 2 | 4 | 1 | 66 | 291.425 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
