UCSF

ZINC22688294

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 25 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) 0.97 4.55 -20.59 1 7 0 84 347.415 9
Mid Mid (pH 6-8) 0.97 6.88 -59.24 2 7 1 85 348.423 9

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

No pre-computed analogs available. Try a structural similarity search.