UCSF

ZINC62038825

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2011 27 No

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

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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) 2.36 3.69 -22.31 3 7 0 105 388.445 8 ↓
Hi High (pH 8-9.5) 2.36 4.47 -49.98 2 7 -1 108 387.437 8 ↓

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

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