UCSF

ZINC02867000

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2004 33 Yes

Popular Name: N-[(1S)-1-[5-[[2-(4-chloro-2-methyl-anilino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]-2-hydro N-[(1S)-1-[5-[[2-(4-chloro-2-met…

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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) 2.54 -3.57 -16.39 3 9 0 118 489.985 9 ↓

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