In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | No |
Popular Name: (4S)-6-fluoro-N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]thiochroman-4-amine (4S)-6-fluoro-N-[[5-(methylsulfa…
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) | 2.83 | 9.88 | -47.47 | 2 | 2 | 1 | 30 | 324.466 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.83 | 9.05 | -7.57 | 1 | 2 | 0 | 25 | 323.458 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.