UCSF

ZINC26063997

Substance Information

In ZINC since Heavy atoms Benign functionality
February 3rd, 2009 27 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) 2.29 4.9 -16.62 2 6 0 71 375.513 10
Mid Mid (pH 6-8) 2.29 6.86 -51.05 3 6 1 72 376.521 10

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