UCSF

ZINC21967458

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 16 Yes

Other Names:

MFCD09046776

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) 0.66 1.77 -54.44 4 4 1 68 221.28 1
Hi High (pH 8-9.5) 0.66 2.43 -86.12 3 4 0 71 220.272 1

Vendor Notes

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

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