In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 18 | Yes |
Popular Name: (4S)-6-fluoro-N-(thiadiazol-4-ylmethyl)thiochroman-4-amine (4S)-6-fluoro-N-(thiadiazol-4-yl…
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) | 1.67 | 5.89 | -49.82 | 2 | 3 | 1 | 42 | 282.389 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.67 | 4.73 | -5.78 | 1 | 3 | 0 | 38 | 281.381 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.