UCSF

ZINC22709946

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 34 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) 5.09 8.93 -14.08 3 9 0 147 473.876 4
Lo Low (pH 4.5-6) 5.09 9.25 -63.16 4 9 1 148 474.884 4

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

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