UCSF

ZINC37247349

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 21 No

Popular Name: 4-bromo-3-nitro-N-[2-(2-pyridyl)ethyl]benzamide 4-bromo-3-nitro-N-[2-(2-pyridyl)…

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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) 2.46 6.77 -18.39 1 6 0 88 350.172 5 ↓
Lo Low (pH 4.5-6) 2.46 7.12 -49.78 2 6 1 89 351.18 5 ↓

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

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