In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 11 | Yes |
Popular Name: 2-[(1R,4R)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]ethanol 2-[(1R,4R)-5-methyl-2,5-diazabic…
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) | -0.29 | -0.6 | -32.14 | 2 | 3 | 1 | 28 | 157.237 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.29 | -3.07 | -3.17 | 1 | 3 | 0 | 27 | 156.229 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.29 | -0.65 | -30.97 | 2 | 3 | 1 | 28 | 157.237 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.29 | 1.82 | -96.25 | 3 | 3 | 2 | 29 | 158.245 | 2 | ↓ |