In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2008 | 36 | Yes |
Popular Name: N-[1-(2-diethylaminoethyl)benzimidazol-2-yl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide N-[1-(2-diethylaminoethyl)benzim…
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) | 4.55 | 15.25 | -51.18 | 2 | 8 | 1 | 85 | 482.612 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.55 | 11.8 | -14.35 | 1 | 8 | 0 | 84 | 481.604 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.