In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 13 | Yes |
Popular Name: 1-(7-bromo-1,3-benzodioxol-5-yl)-N-methyl-methanamine 1-(7-bromo-1,3-benzodioxol-5-yl)…
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) | 2.12 | 3.68 | -46.8 | 2 | 3 | 1 | 35 | 245.096 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.12 | 2.24 | -4.76 | 1 | 3 | 0 | 30 | 244.088 | 2 | ↓ |