UCSF

ZINC47511223

Substance Information

In ZINC since Heavy atoms Benign functionality
September 3rd, 2010 16 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) 1.03 4.25 -12.47 1 6 0 67 219.248 1
Lo Low (pH 4.5-6) 1.03 4.73 -32.28 2 6 1 68 220.256 1

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