UCSF

ZINC64970583

Substance Information

In ZINC since Heavy atoms Benign functionality
July 1st, 2011 25 No

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) -2.33 5.62 -36.32 1 7 1 83 349.455 8
Hi High (pH 8-9.5) 2.14 5.43 -10.45 1 7 0 83 348.447 8

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

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