In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 35 | No |
Popular Name: 4-[3,5-dicarbomethoxy-1-(4-chlorobenzyl)-4H-pyridin-4-yl]-2-ethoxy-6-nitro-phenolate 4-[3,5-dicarbomethoxy-1-(4-chlor…
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) | 4.13 | 13.88 | -62.65 | 0 | 10 | -1 | 134 | 501.899 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.13 | 12.89 | -17.07 | 1 | 10 | 0 | 131 | 502.907 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.