In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 22 | No |
Popular Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-2-methylsulfonyl-ethanamine N-[[5-(1,3-benzothiazol-2-yl)-2-…
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) | 2.63 | 4.36 | -63.33 | 2 | 5 | 1 | 77 | 337.446 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.63 | 2.99 | -18.3 | 1 | 5 | 0 | 72 | 336.438 | 6 | ↓ |