In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 17 | Yes |
Popular Name: (1S)-1-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-cyclopropyl-N-methyl-methanamine (1S)-1-(6-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) | 2.80 | 5.78 | -39.36 | 2 | 3 | 1 | 35 | 299.188 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 5.27 | -4.47 | 1 | 3 | 0 | 30 | 298.18 | 3 | ↓ |