| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 18 | Yes |
Popular Name: 2,5-dimethyl-N3-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrazole-3,4-diamine 2,5-dimethyl-N3-[(4R)-4,5,6,7-te…
| 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) | 1.99 | 5.25 | -6.18 | 3 | 4 | 0 | 56 | 262.382 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.99 | 5.37 | -25.92 | 4 | 4 | 1 | 57 | 263.39 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
