In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2011 | 15 | No |
Popular Name: (2S,6R)-4-[(5-chlorothiadiazol-4-yl)methyl]-2,6-dimethyl-thiomorpholine (2S,6R)-4-[(5-chlorothiadiazol-4…
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) | 2.49 | 4.28 | -4.02 | 0 | 3 | 0 | 29 | 263.819 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.49 | 6.39 | -35.72 | 1 | 3 | 1 | 30 | 264.827 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.