UCSF

ZINC22657883

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 18th, 2008 35 Yes

Popular Name: 2-[[4-(5-tert-butyl-2-methyl-furan-3-carbonyl)piperazin-1-yl]methyl]-5-[(2-chlorophenyl)methoxy]pyra 2-[[4-(5-tert-butyl-2-methyl-fur…

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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) 3.65 11.82 -16.96 0 7 0 76 499.007 7 ↓
Mid Mid (pH 6-8) 3.65 14.16 -63.56 1 7 1 77 500.015 7 ↓

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

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