UCSF

ZINC05790309

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 14th, 2006 27 Yes

Popular Name: 8-(2-hydroxy-3,5-dimethyl-phenyl)-3-(2-hydroxyethyl)-2-phenyl-3,6,7-triazabicyclo[3.3.0]octa-7,9-die 8-(2-hydroxy-3,5-dimethyl-phenyl…

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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) 2.91 4.85 -11.21 3 6 0 89 363.417 4 ↓
Ref Reference (pH 7) 2.91 4.88 -12.39 3 6 0 89 363.417 4 ↓
Hi High (pH 8-9.5) 2.91 5.57 -41.06 2 6 -1 92 362.409 4 ↓

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