UCSF

ZINC66863626

Substance Information

In ZINC since Heavy atoms Benign functionality
September 2nd, 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) 3.91 8.16 -38.41 3 5 1 63 332.468 6
Hi High (pH 8-9.5) 3.91 6.92 -8.73 2 5 0 61 331.46 6

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

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