UCSF

ZINC25494514

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2009 8 Yes

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) -0.01 2.22 -5.9 1 3 0 38 109.132 1
Lo Low (pH 4.5-6) -0.01 2.68 -33.05 2 3 1 39 110.14 1

Vendor Notes

Note Type Comments Provided By
MP 77 - 79 Enamine Building Blocks
MP 77...79 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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