In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-methyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]quinuclidin-3-amine (3R)-3-(aminomethyl)-N-methyl-N-…
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) | 0.24 | 2.29 | -114.01 | 4 | 4 | 2 | 45 | 255.406 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.24 | 2.29 | -26.84 | 3 | 4 | 1 | 43 | 254.398 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.24 | 0.48 | -47.78 | 3 | 4 | 1 | 43 | 254.398 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.24 | 2.89 | -32.61 | 3 | 4 | 1 | 43 | 254.398 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.24 | 2.89 | -110.62 | 4 | 4 | 2 | 45 | 255.406 | 4 | ↓ |