UCSF

ZINC20282414

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 21 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) 1.77 4.29 -44.38 2 5 1 59 287.387 6
Lo Low (pH 4.5-6) 1.77 6.67 -121.66 3 5 2 60 288.395 6

Vendor Notes

Note Type Comments Provided By
MP 187 - 189 Enamine Building Blocks
MP 187...189 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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