UCSF

ZINC37790578

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 13 No

Other Names:

MFCD12808844

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) -1.05 1.93 -18.3 1 5 0 66 184.195 2
Hi High (pH 8-9.5) -0.31 0.8 -50.09 1 5 -1 72 183.187 1

Vendor Notes

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

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