UCSF

ZINC12138843

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 27th, 2008 21 Yes

Popular Name: 4-{3-[(Butylamino)carbonyl]anilino}-4-oxobutanoic acid 4-{3-[(Butylamino)carbonyl]anili…

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CAS Numbers: , 940488-53-9

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) 1.51 -1.89 -60.84 2 6 -1 98 291.327 8 ↓

Vendor Notes

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Warnings IRRITANT Matrix Scientific

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