UCSF

ZINC19515571

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 16 No

Other Names:

MFCD09948886

MFCD13196267

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) 0.31 3 -7.33 3 5 0 75 220.276 2
Ref Reference (pH 7) 0.31 4.02 -7.57 3 5 0 75 220.276 2
Mid Mid (pH 6-8) 0.31 3.56 -38.54 4 5 1 76 221.284 2
Lo Low (pH 4.5-6) 0.31 3.46 -32.04 4 5 1 76 221.284 2

Vendor Notes

Note Type Comments Provided By
MP 149 - 151 Enamine Building Blocks
MP 149...151 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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Analogs ( Draw Identity 99% 90% 80% 70% )