In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 17 | Yes |
Popular Name: (1R,2S)-2-(8-bromo-2,3-dihydro-1,4-benzodioxin-6-yl)cyclopropanecarboxylic (1R,2S)-2-(8-bromo-2,3-dihydro-1…
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) | 2.21 | 6.77 | -47.6 | 0 | 4 | -1 | 59 | 298.112 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.21 | 4.76 | -10.33 | 1 | 4 | 0 | 56 | 299.12 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.