In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2010 | 17 | Yes |
Popular Name: (1R,2R)-1-(4-bromo-2-thienyl)-1-[(2S)-2-methylmorpholin-4-yl]propan-2-amine (1R,2R)-1-(4-bromo-2-thienyl)-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) | 1.98 | 2.52 | -44.27 | 3 | 3 | 1 | 40 | 320.276 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.98 | 2.19 | -2.6 | 2 | 3 | 0 | 38 | 319.268 | 3 | ↓ |