UCSF

ZINC01383836

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 19 Yes

Popular Name: 6-(3-fluorobenzyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine 6-(3-fluorobenzyl)-5,7-dimethyl[…

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CAS Number: 477890-34-9

Other Names:

MFCD02571700

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) 2.53 10.6 -16.46 0 4 0 43 256.284 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 112 - 114 KeyOrganics

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Rings

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

No pre-computed analogs available. Try a structural similarity search.