In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 23 | Yes |
Popular Name: (2R)-1-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one (2R)-1-(2,3-dihydro-1,4-benzothi…
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) | 1.23 | 1.77 | -11.26 | 1 | 5 | 0 | 47 | 335.473 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.23 | 4.11 | -39.01 | 2 | 5 | 1 | 48 | 336.481 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.