UCSF

ZINC47549142

Substance Information

In ZINC since Heavy atoms Benign functionality
September 3rd, 2010 20 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) 1.62 4.73 -12.85 2 5 0 69 273.336 7
Mid Mid (pH 6-8) 1.62 6.58 -41.32 3 5 1 70 274.344 7

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