UCSF

ZINC01384262

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 22 Yes

Popular Name: 3-chloro-5-(4-fluorophenyl)-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine 3-chloro-5-(4-fluorophenyl)-2-me…

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CAS Number: 439097-12-8

Other Names:

MFCD03012261

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) 4.59 3.95 -8.89 0 3 0 30 329.684 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 209 - 211 KeyOrganics

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Rings

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