In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: 3-[[(4aS,7aS)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]methyl]aniline 3-[[(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) | 1.52 | 3.15 | -3.78 | 2 | 3 | 0 | 38 | 232.327 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.52 | 5.39 | -32.82 | 3 | 3 | 1 | 40 | 233.335 | 2 | ↓ |