UCSF

ZINC66450092

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2011 24 No

Popular Name: N-[(1R,3S)-3-methylcyclohexyl]-2-[4-[(2-thioxo-1,3,4-thiadiazol-3-yl)methyl]piperazin-1-yl]acetamide N-[(1R,3S)-3-methylcyclohexyl]-2…

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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) 1.82 4.16 -14.97 1 6 0 53 369.56 5 ↓
Lo Low (pH 4.5-6) 1.82 6.57 -41.52 2 6 1 55 370.568 5 ↓

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

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