UCSF

ZINC66167211

Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2011 20 No

Download: MOL2 SDF SMILES Flexibase

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) -1.33 2.01 -16.52 2 7 0 91 274.28 2
Hi High (pH 8-9.5) -0.25 0.35 -56.58 1 7 -1 98 273.272 2

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

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