UCSF

ZINC21986199

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 29 No

CAS Number: 55268-75-2

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) -1.39 2.32 -82.64 3 12 -1 177 423.383 8

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