In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 10th, 2011 | 31 | Yes |
Popular Name: N-[2-[benzyl(ethyl)amino]ethyl]-8-chloro-7-methoxy-thieno[2,3-b]quinoline-2-carboxamide N-[2-[benzyl(ethyl)amino]ethyl]-…
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) | 5.10 | 10.87 | -50.08 | 2 | 5 | 1 | 56 | 455.003 | 8 | ↓ |
Hi High (pH 8-9.5) | 5.10 | 8.74 | -15.71 | 1 | 5 | 0 | 54 | 453.995 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.