UCSF

ZINC26297690

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2009 26 No

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) 4.48 10.59 -56.07 1 6 -1 73 425.346 5
Hi High (pH 8-9.5) 4.55 9.69 -92.47 0 6 -2 79 424.338 5
Lo Low (pH 4.5-6) 3.76 10.75 -24.15 2 6 0 76 426.354 5

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