UCSF

ZINC00687399

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 32 Yes

Popular Name: 4-chloro-N-{1-[4-ethyl-5-({2-[3-(methylsulfanyl)anilino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide 4-chloro-N-{1-[4-ethyl-5-({2-[3-…

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Other Names:

MFCD04151585

Download: MOL2 SDF SMILES Flexibase

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) 3.90 -1.64 -13.13 0 2 0 88 490.054 7 ↓

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