In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 24 | Yes |
Popular Name: 6-bromo-N,N-diethyl-2-(4-pyridyl)quinoline-4-carboxamide 6-bromo-N,N-diethyl-2-(4-pyridyl…
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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) | 3.28 | 9.23 | -10.81 | 0 | 4 | 0 | 46 | 384.277 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.28 | 9.68 | -47.51 | 1 | 4 | 1 | 47 | 385.285 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.