In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 17 | Yes |
Popular Name: 2-[(1R,4R)-5-benzyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]ethanol 2-[(1R,4R)-5-benzyl-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) | 1.11 | 2.97 | -32.08 | 2 | 3 | 1 | 28 | 233.335 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.11 | 0.73 | -3.99 | 1 | 3 | 0 | 27 | 232.327 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.11 | 3.14 | -34.43 | 2 | 3 | 1 | 28 | 233.335 | 4 | ↓ |