In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 16 | Yes |
Popular Name: 1-[2-(5-chloro-2-fluoro-phenyl)thiazol-5-yl]-N-methyl-methanamine 1-[2-(5-chloro-2-fluoro-phenyl)t…
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) | 3.36 | 6.25 | -43.72 | 2 | 2 | 1 | 29 | 257.741 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.36 | 4.81 | -5.9 | 1 | 2 | 0 | 25 | 256.733 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.