In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2008 | 29 | Yes |
Popular Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[2-(diisopropylamino)ethyl]benzamide 4-(1,3-benzothiazol-2-ylsulfanyl…
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) | 5.26 | 11.42 | -47.13 | 2 | 4 | 1 | 46 | 428.647 | 9 | ↓ |
Hi High (pH 8-9.5) | 5.26 | 9.34 | -15.66 | 1 | 4 | 0 | 45 | 427.639 | 9 | ↓ |