In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 17 | No |
Popular Name: (1R,5S)-8-[(3S)-1,1-dioxothian-3-yl]-8-azabicyclo[3.2.1]octan-3-amine (1R,5S)-8-[(3S)-1,1-dioxothian-3…
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) | -0.22 | -0.58 | -54.37 | 3 | 4 | 1 | 65 | 259.395 | 1 | ↓ |
Lo Low (pH 4.5-6) | -0.22 | 1.58 | -124.24 | 4 | 4 | 2 | 66 | 260.403 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.