UCSF

ZINC21952245

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 17 Yes

Other Names:

MFCD08442879

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) 0.42 4.65 -96.03 4 4 2 50 241.379 4
Hi High (pH 8-9.5) 0.42 2.41 -48.76 3 4 1 49 240.371 4

Vendor Notes

Note Type Comments Provided By
MP 191 - 194 Enamine Building Blocks
MP 191...194 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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