In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 21 | No |
Popular Name: [(1S,3R,4S,5R)-4-[(E)-2-chlorovinyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] [(1S,3R,4S,5R)-4-[(E)-2-chlorovi…
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) | 3.79 | 10.88 | -41.05 | 1 | 3 | 1 | 31 | 306.813 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.79 | 8.54 | -5.27 | 0 | 3 | 0 | 30 | 305.805 | 4 | ↓ |