In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 15 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-isopropyl-N-methyl-quinuclidin-3-amine (3R)-3-(aminomethyl)-N-isopropyl…
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) | 0.54 | 2.07 | -113.96 | 4 | 3 | 2 | 35 | 213.369 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.54 | -0.75 | -41.22 | 3 | 3 | 1 | 34 | 212.361 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 1.31 | -1.6 | 3 | 3 | 0 | 34 | 212.361 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.54 | -0.13 | -15.5 | 4 | 3 | 0 | 35 | 213.369 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.54 | 3.84 | -17.2 | 5 | 3 | 0 | 37 | 214.377 | 3 | ↓ |