UCSF

ZINC03925393

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2005 35 No

Popular Name: 5-[[4-(diethoxymethyl)-5-hydroxy-6-methyl-3-(phosphonooxymethyl)-2-pyridyl]azo]benzene-1,3-dicarboxy 5-[[4-(diethoxymethyl)-5-hydroxy…

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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) 2.34 6.14 -340.16 1 14 -4 229 509.364 12 ↓
Hi High (pH 8-9.5) 2.34 6.99 -437.43 0 14 -5 232 508.356 12 ↓
Mid Mid (pH 6-8) 2.34 4.99 -201.58 2 14 -3 226 510.372 12 ↓

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