In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2011 | 18 | Yes |
Popular Name: (3S)-1-(1,3-benzothiazol-6-yl)-5-oxo-pyrrolidine-3-carboxylic (3S)-1-(1,3-benzothiazol-6-yl)-5…
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) | 1.05 | 5.57 | -42.27 | 0 | 5 | -1 | 73 | 261.282 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.05 | 3.59 | -14.59 | 1 | 5 | 0 | 71 | 262.29 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.