UCSF

ZINC55502251

Substance Information

In ZINC since Heavy atoms Benign functionality
December 15th, 2010 24 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) 2.74 3.5 -47.04 1 6 -1 99 338.424 7
Hi High (pH 8-9.5) 2.74 3.57 -12.09 1 6 0 99 338.424 8

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

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