In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 18 | Yes |
Popular Name: (1R)-N-methyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propan-1-amine (1R)-N-methyl-1-[5-(trifluoromet…
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) | 3.60 | 6.24 | -41.84 | 2 | 2 | 1 | 29 | 275.319 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.60 | 4.98 | -5.7 | 1 | 2 | 0 | 25 | 274.311 | 4 | ↓ |