| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 19 | Yes |
Popular Name: (2R,3S)-N-[(5-ethoxy-1,3,4-thiadiazol-2-yl)methyl]-3-pyrazol-1-yl-butan-2-amine (2R,3S)-N-[(5-ethoxy-1,3,4-thiad…
| 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) | 1.15 | 2.79 | -48.97 | 2 | 6 | 1 | 69 | 282.393 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.15 | 1.59 | -8.84 | 1 | 6 | 0 | 65 | 281.385 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
