| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2010 | 21 | No |
Popular Name: (E)-3-[5-[(5-chloro-2-thienyl)methyl-methyl-amino]-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic (E)-3-[5-[(5-chloro-2-thienyl)me…
| 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) | 2.65 | 8.36 | -55.62 | 1 | 5 | 0 | 62 | 325.821 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.65 | 8.22 | -52.42 | 0 | 5 | -1 | 61 | 324.813 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
