UCSF

ZINC35105418

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2009 35 Yes

Popular Name: (Z)-6-((1-(2-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-5-imino-2-(2-oxo-2-(piperidin-1-yl)ethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one (Z)-6-((1-(2-chlorophenyl)-2,5-d…

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Physical Representations

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) 2.20 12.03 -14.65 2 8 0 99 509.035 3 ↓
Mid Mid (pH 6-8) 2.20 11.78 -17.87 2 8 0 99 509.035 3 ↓
Mid Mid (pH 6-8) 2.20 11.97 -16.73 2 8 0 99 509.035 3 ↓

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )