In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 35 | Yes |
Popular Name: 5-[2-(4-methylpiperazin-1-yl)-4-pyridyl]-2-(4-methylsulfonylphenyl)-4-(m-tolyl)thiazole 5-[2-(4-methylpiperazin-1-yl)-4-…
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) | 4.72 | 12.49 | -51.74 | 1 | 6 | 1 | 68 | 505.689 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.72 | 10.14 | -15.16 | 0 | 6 | 0 | 66 | 504.681 | 5 | ↓ |