| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 18 | Yes |
Popular Name: 2,5-dimethyl-N3-[(1S)-1-(2-thienyl)butyl]pyrazole-3,4-diamine 2,5-dimethyl-N3-[(1S)-1-(2-thien…
| 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) | 2.92 | 5.29 | -4.8 | 3 | 4 | 0 | 56 | 264.398 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.92 | 5.74 | -26.52 | 4 | 4 | 1 | 57 | 265.406 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
