UCSF

ZINC19399616

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2008 9 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) 0.49 1.86 -34.23 2 2 1 20 129.227 4
Mid Mid (pH 6-8) 0.49 4.39 -103.08 3 2 2 21 130.235 4

Vendor Notes

Note Type Comments Provided By
MP 185 - 187 Enamine Building Blocks
MP 185...187 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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