In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | No |
Popular Name: 4-(chloromethyl)-2-[[(2R)-2-ethyl-1-piperidyl]methyl]thiazole 4-(chloromethyl)-2-[[(2R)-2-ethy…
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) | 2.99 | 7.94 | -32.45 | 1 | 2 | 1 | 17 | 259.826 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.99 | 6.35 | -4.05 | 0 | 2 | 0 | 16 | 258.818 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.