In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 25th, 2010 | 19 | Yes |
Popular Name: 4-[[(4aS,7aS)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]methyl]benzoic 4-[[(4aS,7aS)-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 | 5.84 | -49.2 | 0 | 4 | -1 | 53 | 260.313 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.38 | 8.08 | -69.58 | 1 | 4 | 0 | 54 | 261.321 | 3 | ↓ |