UCSF

ZINC00313208

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 18 Yes

Popular Name: 3-[1,1'-biphenyl]-4-yl-1H-pyrazol-5-ylamine 3-[1,1'-biphenyl]-4-yl-1H-pyrazo…

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CAS Number: 208519-16-8

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) 3.39 6.77 -8.34 3 3 0 55 235.29 2 ↓
Lo Low (pH 4.5-6) 3.39 6.84 -34.76 4 3 1 56 236.298 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 250 KeyOrganics
Warnings IRRITANT Matrix Scientific

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