UCSF

ZINC36300672

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2009 16 Yes

Other Names:

MFCD12086794

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) 1.22 4.94 -34.36 2 4 1 43 229.344 5
Mid Mid (pH 6-8) 1.22 4.07 -42.16 2 4 1 46 229.344 5
Mid Mid (pH 6-8) 1.22 6.29 -103.69 3 4 2 47 230.352 5

Vendor Notes

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

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