| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2014 | 21 | Yes |
Popular Name: Methyl 2-(2-chlorophenyl)-2-(4,5-dihydrothieno[2,3-c]pyridin-6(7H)-yl)acetate Methyl 2-(2-chlorophenyl)-2-(4,5…
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CAS Number: [144457-43-2]
| 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) | 3.88 | 9.05 | -5.97 | 0 | 3 | 0 | 30 | 321.829 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.88 | 10.59 | -32.24 | 1 | 3 | 1 | 31 | 322.837 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.