UCSF

ZINC66157264

Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2011 45 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) 6.33 11.45 -13.44 1 9 0 97 609.675 10
Mid Mid (pH 6-8) 6.33 12.08 -62.38 0 9 -1 100 608.667 10

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

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