In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 19 | No |
Popular Name: (1S,2R)-1-(5-bromo-2-thienyl)-1-(1,1-dioxo-1,4-thiazinan-4-yl)butan-2-amine (1S,2R)-1-(5-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) | 1.76 | 1.98 | -61.1 | 3 | 4 | 1 | 65 | 368.342 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.76 | 1.15 | -11.48 | 2 | 4 | 0 | 63 | 367.334 | 4 | ↓ |