UCSF

ZINC65532786

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 28 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) 2.45 5.35 -34.72 2 6 1 77 375.452 1
Mid Mid (pH 6-8) 2.45 6.35 -94.96 3 6 2 79 376.46 1

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

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