In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 18 | Yes |
Popular Name: (1S,2R)-2-[[(1R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]amino]cycloheptanol (1S,2R)-2-[[(1R,8aR)-1,2,3,5,6,7…
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) | 2.40 | 3.41 | -31.45 | 3 | 3 | 1 | 40 | 253.41 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 4.63 | -29.06 | 3 | 3 | 1 | 37 | 253.41 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.