UCSF

ZINC56154958

Substance Information

In ZINC since Heavy atoms Benign functionality
December 28th, 2010 26 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

    None

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) 1.53 5.71 -55.27 1 8 -1 108 372.43 7
Lo Low (pH 4.5-6) 1.53 5.71 -20.04 2 8 0 105 373.438 7

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

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