UCSF

ZINC20015371

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2008 18 Yes

Other Names:

MFCD08444674

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) 3.15 8.1 -41.66 2 3 1 29 262.402 4
Hi High (pH 8-9.5) 3.15 5.77 -7.11 1 3 0 28 261.394 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% )