In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2009 | 19 | Yes |
Popular Name: 2-(1,3-benzothiazol-2-ylamino)-1-piperazin-1-yl-ethanone 2-(1,3-benzothiazol-2-ylamino)-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) | 1.00 | 4.16 | -55.89 | 3 | 5 | 1 | 62 | 277.373 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.00 | 2.85 | -11.92 | 2 | 5 | 0 | 57 | 276.365 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.