In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 20 | Yes |
Popular Name: 2-[(2R)-2-methylpyrrolidin-1-yl]-4-phenyl-thiazole-5-carboxylic 2-[(2R)-2-methylpyrrolidin-1-yl]…
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) | 3.31 | 7.8 | -60.41 | 0 | 4 | -1 | 56 | 287.364 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.31 | 8.26 | -41.8 | 1 | 4 | 0 | 58 | 288.372 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.