UCSF

ZINC31284439

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2009 16 Yes

CAS Numbers: 11031-45-1 , [11031-45-1]

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) 4.00 6.72 -4.4 1 1 0 20 220.356 4

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