In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 2nd, 2011 | 16 | Yes |
Popular Name: 4-methyl-2-(piperazin-1-ylmethyl)thiazole-5-carboxylic 4-methyl-2-(piperazin-1-ylmethyl…
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) | -0.27 | 2.09 | -73.3 | 2 | 5 | 0 | 73 | 241.316 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.27 | 0.75 | -45.77 | 1 | 5 | -1 | 68 | 240.308 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.