UCSF

ZINC39265436

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 25 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 1.43 5.98 -12.48 1 7 0 96 352.423 4
Mid Mid (pH 6-8) 1.43 8.14 -56.3 2 7 1 97 353.431 4

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