UCSF

ZINC19471275

Substance Information

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

Other Names:

MFCD09935665

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) 0.44 3.08 -33.92 4 5 1 74 221.284 3
Ref Reference (pH 7) 0.31 3.57 -33.55 4 5 1 76 221.284 2
Mid Mid (pH 6-8) 0.44 3.43 -90.69 5 5 2 75 222.292 3

Vendor Notes

Note Type Comments Provided By
MP 179 - 181 Enamine Building Blocks
MP 179...181 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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