| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 19 | No |
Popular Name: (2S)-1-ethylsulfanyl-N-[[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]propan-2-amine (2S)-1-ethylsulfanyl-N-[[3-(3-py…
| 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) | 1.76 | 4.65 | -43.4 | 2 | 5 | 1 | 68 | 279.389 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.76 | 3.43 | -7.92 | 1 | 5 | 0 | 64 | 278.381 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 5.11 | -89.37 | 3 | 5 | 2 | 70 | 280.397 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
