UCSF

ZINC69663609

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2011 23 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) 0.84 5.54 -47.87 1 8 -1 108 334.381 3
Lo Low (pH 4.5-6) 1.02 5.81 -30.19 2 8 0 109 335.389 3

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

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