UCSF

ZINC22750487

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 37 No

Popular Name: [4-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]-methyl-(1-methylpyrazol-4-yl)BLAH [4-[(3,5-dimethylpyrazol-1-yl)me…

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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) 2.70 9 -21.72 1 11 0 117 492.547 4 ↓

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Rings

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

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