UCSF

ZINC69190556

Substance Information

In ZINC since Heavy atoms Benign functionality
October 20th, 2011 24 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 2.57 5.85 -8.79 2 6 0 71 331.416 7
Lo Low (pH 4.5-6) 2.57 7.95 -44.73 3 6 1 72 332.424 7

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

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