In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 19 | Yes |
Popular Name: (R)-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-(3-pyridyl)methanamine (R)-(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) | 1.91 | 4.01 | -48.52 | 3 | 4 | 1 | 59 | 322.182 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 3.68 | -7.19 | 2 | 4 | 0 | 57 | 321.174 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.