UCSF

ZINC38002292

Substance Information

In ZINC since Heavy atoms Benign functionality
December 21st, 2009 13 Yes

Other Names:

MFCD12819888

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) 2.62 3.16 -39.64 3 2 1 37 265.196 4
Hi High (pH 8-9.5) 2.62 1.9 -3.47 2 2 0 32 264.188 4

Vendor Notes

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

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