UCSF

ZINC05757942

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2006 10 No

CAS Numbers: 49824-43-3 , [35127-50-5]

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) 3.57 2.46 -4.94 0 1 0 17 142.242 6

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