In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 20 | Yes |
Popular Name: N-[(S)-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-thiazol-2-yl-methyl]ethanamine N-[(S)-(5-bromo-2,3-dihydro-1,4-…
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) | 2.76 | 5.84 | -39.36 | 2 | 4 | 1 | 48 | 356.265 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.76 | 4.73 | -7.99 | 1 | 4 | 0 | 43 | 355.257 | 4 | ↓ |