In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 19 | Yes |
Popular Name: (3S)-3-(aminomethyl)-N-methyl-N-(3-pyridylmethyl)quinuclidin-3-amine (3S)-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) | 0.03 | 3.79 | -119.95 | 4 | 4 | 2 | 48 | 262.401 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.03 | 1.37 | -52.47 | 3 | 4 | 1 | 47 | 261.393 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.03 | 3.68 | -37.69 | 3 | 4 | 1 | 47 | 261.393 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.03 | 4.25 | -191.67 | 5 | 4 | 3 | 49 | 263.409 | 4 | ↓ |