In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2011 | 17 | Yes |
Popular Name: 2-[cyclobutylmethyl(methyl)amino]-4-ethyl-thiazole-5-carboxylic 2-[cyclobutylmethyl(methyl)amino…
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) | 2.74 | 8.21 | -52.57 | 0 | 4 | -1 | 56 | 253.347 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 8.59 | -39.88 | 1 | 4 | 0 | 58 | 254.355 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.