UCSF

ZINC71789539

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2012 31 Yes

CAS Numbers: 86123-10-6 , [86123-10-6]

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) 7.12 13.96 -13.02 1 5 0 65 415.489 9

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