UCSF

ZINC62038827

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2011 28 No

Popular Name: (2S)-2-[2-(4-ethoxyanilino)-2-oxo-ethyl]sulfanyl-N-(5-formyl-2-hydroxy-phenyl)propanamide (2S)-2-[2-(4-ethoxyanilino)-2-ox…

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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) 2.74 4.65 -21.99 3 7 0 105 402.472 9 ↓
Hi High (pH 8-9.5) 2.74 5.42 -49.47 2 7 -1 108 401.464 9 ↓

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

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