In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 17 | Yes |
Popular Name: (1S)-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propan-1-amine (1S)-1-[5-(trifluoromethyl)-1,3-…
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) | 1.34 | 4.51 | -47.4 | 3 | 2 | 1 | 41 | 261.292 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.34 | 4.17 | -6.21 | 2 | 2 | 0 | 39 | 260.284 | 3 | ↓ |