UCSF

ZINC40124639

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 24th, 2010 27 No

Popular Name: (2S)-3-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-4-hydroxy-2-(4-methylsulfanylphenyl)-1,2-dihydropyr (2S)-3-(2,3-dihydro-1,4-benzodio…

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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) 2.08 5.19 -58.6 1 6 -1 88 382.417 4 ↓
Lo Low (pH 4.5-6) 2.08 4.43 -16.64 2 6 0 85 383.425 4 ↓

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