UCSF

ZINC19229994

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2008 17 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) 1.76 3.87 -43.9 2 3 1 33 248.375 2
Hi High (pH 8-9.5) 1.76 2.45 -7.15 1 3 0 28 247.367 2

Vendor Notes

Note Type Comments Provided By
MP 243 - 245 Enamine Building Blocks
MP 243...245 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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