In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 17 | Yes |
Popular Name: (S)-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-[(1S,2R)-2-methylcyclopropyl]methanamine (S)-(6-bromo-2,3-dihydro-1,4-ben…
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) | 1.15 | 4.98 | -42.99 | 3 | 3 | 1 | 46 | 299.188 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.15 | 4.69 | -4.67 | 2 | 3 | 0 | 44 | 298.18 | 2 | ↓ |