UCSF

ZINC36870912

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 13 Yes

Other Names:

MFCD12104443

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) -0.26 1.11 -51.65 4 4 1 69 175.215 2
Hi High (pH 8-9.5) -0.26 0.77 -9.89 3 4 0 68 174.207 2

Vendor Notes

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

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