UCSF

ZINC67571181

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2011 20 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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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) 2.70 8.5 -34.41 1 4 1 34 299.822 7
Hi High (pH 8-9.5) 2.70 6.3 -7.16 0 4 0 33 298.814 7

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Rings

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