UCSF

ZINC19926785

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 37 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) 3.99 10.45 -49.14 4 12 1 151 504.575 11
Hi High (pH 8-9.5) 3.99 8.2 -16.52 3 12 0 150 503.567 11

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