UCSF

ZINC09096391

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 8th, 2007 14 Yes

Popular Name: N-(5-BROMOPYRIDIN-2-YL)PIVALAMIDE N-(5-BROMOPYRIDIN-2-YL)PIVALAMIDE

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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) 2.90 -0.01 -11.14 1 3 0 41 257.131 2 ↓
Lo Low (pH 4.5-6) 2.90 -0.36 -27.92 2 3 1 43 258.139 2 ↓

Activity (Go SEA)

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