UCSF

ZINC16869586

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2008 31 Yes

Popular Name: (2S)-N-allyl-2-[[4-(2,5-dimethylphenyl)-5-oxo-[1,2,4]triazolo[4,5-a]quinazolin-1-yl]sulfanyl]propana (2S)-N-allyl-2-[[4-(2,5-dimethyl…

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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) 4.44 14.2 -16.07 1 7 0 81 433.537 6 ↓

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

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