UCSF

ZINC03508415

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2004 31 Yes

Popular Name: 2-[[4-(3,4-dimethylphenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1-[(3R,5R)-3,5-dimethylpiperidino] 2-[[4-(3,4-dimethylphenyl)-5-(4-…

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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) 4.49 13.98 -11.58 0 6 0 64 435.597 5 ↓

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