In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 37 | No |
Popular Name: 4-(6-bromo-1,3-benzodioxol-5-yl)-1-veratryl-4H-pyridine-3,5-dicarboxylic-acid-diethyl-ester 4-(6-bromo-1,3-benzodioxol-5-yl)…
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) | 4.18 | 13.43 | -17.51 | 0 | 9 | 0 | 93 | 574.424 | 11 | ↓ |
No pre-computed analogs available. Try a structural similarity search.