UCSF

ZINC39696864

Substance Information

In ZINC since Heavy atoms Benign functionality
March 3rd, 2010 34 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) 1.66 5.54 -53.06 3 8 1 92 467.59 5
Mid Mid (pH 6-8) 1.66 7.96 -108.45 4 8 2 93 468.598 5

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