In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 17 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-[(1R)-1,2-dimethylpropyl]-N-methyl-quinuclidin-3-amine (3R)-3-(aminomethyl)-N-[(1R)-1,2…
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) | 1.32 | 3.15 | -107.61 | 4 | 3 | 2 | 35 | 241.423 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.32 | 2.82 | -32.15 | 3 | 3 | 1 | 34 | 240.415 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.32 | 1.27 | -40.81 | 3 | 3 | 1 | 34 | 240.415 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 1.09 | -123.89 | 4 | 3 | 2 | 35 | 241.423 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.32 | 4.94 | -218.41 | 5 | 3 | 3 | 37 | 242.431 | 4 | ↓ |