| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2011 | 21 | Yes |
Popular Name: 2-[(4R)-4-[[(1R)-1-(3-methyl-2-thienyl)ethyl]amino]-4,5,6,7-tetrahydroindazol-1-yl]ethanol 2-[(4R)-4-[[(1R)-1-(3-methyl-2-t…
| 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) | 1.58 | 5.12 | -39.5 | 3 | 4 | 1 | 55 | 306.455 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.58 | 4.1 | -7.67 | 2 | 4 | 0 | 50 | 305.447 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
