In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 15 | Yes |
Popular Name: 1-(5-bromo-2-thienyl)-N-[[(2R)-1,4-dioxan-2-yl]methyl]methanamine 1-(5-bromo-2-thienyl)-N-[[(2R)-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) | 1.96 | 4.37 | -44.84 | 2 | 3 | 1 | 35 | 293.206 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 2.96 | -5.24 | 1 | 3 | 0 | 30 | 292.198 | 4 | ↓ |