UCSF

ZINC01386222

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 21 Yes

Popular Name: 2-(methylsulfanyl)-7-phenyl-5-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine 2-(methylsulfanyl)-7-phenyl-5-(t…

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CAS Number: 439107-82-1

Download: MOL2 SDF SMILES Flexibase

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) 3.79 10.42 -9.85 0 4 0 43 310.304 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 140 - 142 KeyOrganics

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