In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: (2R)-2-[(4aS,7aS)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]cycloheptanone (2R)-2-[(4aS,7aS)-3,4a,5,6,7,7a-…
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) | 2.15 | 4.3 | -5.83 | 0 | 3 | 0 | 30 | 237.343 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.15 | 6.47 | -32.15 | 1 | 3 | 1 | 31 | 238.351 | 1 | ↓ |