In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2010 | 19 | Yes |
Popular Name: (2S)-2-[(S)-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-hydroxy-methyl]butanoic (2S)-2-[(S)-(5-bromo-2,3-dihydro…
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) | 2.06 | 4.39 | -45.6 | 1 | 5 | -1 | 79 | 330.154 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.06 | 2.58 | -9.41 | 2 | 5 | 0 | 76 | 331.162 | 4 | ↓ |