In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 19 | Yes |
Popular Name: 2-[cycloheptyl(methyl)amino]-4-ethyl-thiazole-5-carboxylic 2-[cycloheptyl(methyl)amino]-4-e…
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) | 4.11 | 9.1 | -51.17 | 0 | 4 | -1 | 56 | 281.401 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.11 | 9.47 | -38.03 | 1 | 4 | 0 | 58 | 282.409 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.