In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 14 | Yes |
Popular Name: 4-[(4aR,7aR)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]butan-1-ol 4-[(4aR,7aR)-3,4a,5,6,7,7a-hexah…
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) | 0.98 | 0.56 | -4.4 | 1 | 3 | 0 | 33 | 199.294 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.98 | 2.77 | -35.41 | 2 | 3 | 1 | 34 | 200.302 | 4 | ↓ |