UCSF

ZINC66450121

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2011 26 No

Popular Name: 2-fluoro-N-[2-[4-[(5-methyl-2-thioxo-1,3,4-thiadiazol-3-yl)methyl]piperazin-1-yl]ethyl]benzamide 2-fluoro-N-[2-[4-[(5-methyl-2-th…

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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) 0.94 4.63 -20.85 1 6 0 53 395.529 6 ↓
Mid Mid (pH 6-8) 0.94 6.9 -58.23 2 6 1 55 396.537 6 ↓

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

No pre-computed analogs available. Try a structural similarity search.