UCSF

ZINC49554866

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 20 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) 0.92 7.76 -118.03 3 5 2 58 283.416 7
Hi High (pH 8-9.5) 0.92 5.87 -37.3 2 5 1 54 282.408 7

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

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