UCSF

ZINC52583256

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2010 25 No

Popular Name: N-isopropyl-2-[[5-(2-methoxyanilino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl-methyl-amino]acetamide N-isopropyl-2-[[5-(2-methoxyanil…

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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) 2.81 4.92 -15.4 2 7 0 71 381.527 8 ↓
Mid Mid (pH 6-8) 2.81 7.31 -39.45 3 7 1 73 382.535 8 ↓

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

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