UCSF

ZINC20438787

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 10 Yes

Other Names:

MFCD06212595

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) -0.45 -0.04 -41.77 4 3 1 61 139.178 1
Hi High (pH 8-9.5) -0.45 -0.44 -12.79 3 3 0 59 138.17 1

Vendor Notes

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

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