UCSF

ZINC65530295

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 21 Yes

Popular Name: N'-{2-nitrobenzylidene}-2-[(1-phenyl-1H-tetraazol-5-yl)sulfanyl]acetohydrazide N'-{2-nitrobenzylidene}-2-[(1-ph…

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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) 1.37 8.82 -45.24 2 4 1 34 283.399 3 ↓
Lo Low (pH 4.5-6) 1.37 8.79 -75.44 3 4 2 39 284.407 3 ↓
Lo Low (pH 4.5-6) 1.37 10.02 -122.02 3 4 2 39 284.407 3 ↓
Lo Low (pH 4.5-6) 1.37 9.33 -84.93 3 4 2 36 284.407 3 ↓

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Rings

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

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