In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: [2-[(4aS,7aR)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]-3-quinolyl]methanol [2-[(4aS,7aR)-3,4a,5,6,7,7a-hexa…
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) | 2.38 | 5.47 | -8.23 | 1 | 4 | 0 | 46 | 284.359 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 5.9 | -24.6 | 2 | 4 | 1 | 47 | 285.367 | 2 | ↓ |