UCSF

ZINC05522194

Substance Information

In ZINC since Heavy atoms Benign functionality
February 4th, 2006 24 Yes

Other Names:

MFCD00382307

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) 4.81 7.2 -11.33 1 4 0 60 356.683 3
Hi High (pH 8-9.5) 4.81 8 -34.48 0 4 -1 63 355.675 3

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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