UCSF

ZINC04143584

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2005 27 Yes

Popular Name: 2-(2,4-dimethylphenyl)-5-methyl-8-(4-pyridylmethyl)-3,5,8-triazabicyclo[4.3.0]non-10-ene-4,9-dione 2-(2,4-dimethylphenyl)-5-methyl-…

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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) 2.70 -1.42 -19.49 1 6 0 65 362.433 3 ↓
Lo Low (pH 4.5-6) 2.70 -1.31 -50.35 2 6 1 66 363.441 3 ↓

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