In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 24 | Yes |
Popular Name: (3R)-N-[[2-(2-dimethylaminoethyloxy)-3-methoxy-phenyl]methyl]quinuclidin-3-amine (3R)-N-[[2-(2-dimethylaminoethyl…
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) | 2.00 | 8.42 | -106.54 | 3 | 5 | 2 | 39 | 335.492 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.00 | 5.91 | -35.65 | 2 | 5 | 1 | 38 | 334.484 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.00 | 9.46 | -199.98 | 4 | 5 | 3 | 44 | 336.5 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.