UCSF

ZINC20283437

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 10 Yes

Other Names:

MFCD09728370

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) 0.42 1.12 -38.63 3 2 1 31 143.254 3
Hi High (pH 8-9.5) 0.42 3.33 -26.59 3 2 1 30 143.254 3
Mid Mid (pH 6-8) 0.42 3.12 -115.77 4 2 2 32 144.262 3

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% )