In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 16 | Yes |
Popular Name: 4-[5-[(1R)-1-hydroxyethyl]-4-methyl-thiazol-2-yl]piperazin-2-one 4-[5-[(1R)-1-hydroxyethyl]-4-met…
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) | 0.59 | 0.19 | -9.74 | 2 | 5 | 0 | 65 | 241.316 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.59 | 0.59 | -33.58 | 3 | 5 | 1 | 67 | 242.324 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.