In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: (3S)-3-[[(4R)-thiochroman-4-yl]amino]-2,3-dihydrobenzofuran-6-ol (3S)-3-[[(4R)-thiochroman-4-yl]a…
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) | 2.24 | 5.69 | -46.88 | 3 | 3 | 1 | 46 | 300.403 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.24 | 5.02 | -7.51 | 2 | 3 | 0 | 41 | 299.395 | 2 | ↓ |