In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 19 | Yes |
Popular Name: (3R)-3-(aminomethyl)-N-methyl-N-[(1R,2R)-2-methylcyclohexyl]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) | 2.02 | 2.55 | -44.16 | 3 | 3 | 1 | 34 | 266.453 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 6.55 | -97.65 | 4 | 3 | 2 | 35 | 267.461 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 2.15 | -119.14 | 4 | 3 | 2 | 35 | 267.461 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 4.75 | -30.93 | 3 | 3 | 1 | 34 | 266.453 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 4.98 | -110.85 | 4 | 3 | 2 | 35 | 267.461 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.02 | 6.64 | -211.85 | 5 | 3 | 3 | 37 | 268.469 | 3 | ↓ |