UCSF

ZINC19479938

Substance Information

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

Other Names:

MFCD09939229

MFCD13196252

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) 0.37 3.04 -7.64 3 5 0 75 220.276 2
Ref Reference (pH 7) 0.50 3.07 -31.55 4 5 1 74 221.284 3
Lo Low (pH 4.5-6) 0.37 3.35 -31.73 4 5 1 76 221.284 2
Lo Low (pH 4.5-6) 0.37 3.55 -33.46 4 5 1 76 221.284 2

Vendor Notes

Note Type Comments Provided By
MP 165 - 167 Enamine Building Blocks
MP 165...167 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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