UCSF

ZINC12914491

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2008 27 Yes

Popular Name: 1-[4-(3-methyl-6-phenyl-isoxazolo[5,4-b]pyridine-4-carbonyl)piperazin-1-yl]ethanone 1-[4-(3-methyl-6-phenyl-isoxazol…

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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) 1.09 6.03 -18.23 0 7 0 80 364.405 2 ↓

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