UCSF

ZINC95868110

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2014 23 No

Other Names:

MFCD00058139

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) -2.38 -4.84 -185.55 2 12 -3 184 344.2 4
Mid Mid (pH 6-8) -2.38 -5.99 -88.94 3 12 -2 181 345.208 4

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

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