In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 15 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-methyl-N-propyl-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) | 0.75 | 3.34 | -100.87 | 4 | 3 | 2 | 35 | 213.369 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.75 | 3.29 | -33.2 | 3 | 3 | 1 | 34 | 212.361 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.75 | 0.91 | -43.96 | 3 | 3 | 1 | 34 | 212.361 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.75 | 5.12 | -213.78 | 5 | 3 | 3 | 37 | 214.377 | 4 | ↓ |