UCSF

ZINC37394098

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 14 No

Other Names:

MFCD12148683

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 3.35 -10.4 1 5 0 65 203.238 7
Lo Low (pH 4.5-6) 0.66 4.68 -46.42 2 5 1 69 204.246 7

Vendor Notes

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

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