UCSF

ZINC95875821

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2014 35 No

CAS Number: 957054-50-1

Other Names:

MFCD11616196

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 1.23 5.23 -26.77 0 10 0 105 515.665 5
Lo Low (pH 4.5-6) 1.23 7.38 -75.39 1 10 1 106 516.673 5

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