UCSF

ZINC39962912

Substance Information

In ZINC since Heavy atoms Benign functionality
March 19th, 2010 28 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 2.84 7.77 -14.92 2 6 0 84 393.83 3
Hi High (pH 8-9.5) 4.14 7.44 -53.1 1 6 -1 87 392.822 3

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