In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 23 | No |
Popular Name: N-(1,3-benzothiazol-2-yl)-2-[(2S)-2-chloro-2-cyano-ethyl]benzamide N-(1,3-benzothiazol-2-yl)-2-[(2S…
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) | 3.89 | 9.55 | -13.31 | 1 | 4 | 0 | 66 | 341.823 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.96 | 8.65 | -40.72 | 0 | 4 | -1 | 72 | 340.815 | 4 | ↓ |