UCSF

ZINC03357022

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 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) 0.51 5.77 -58.31 0 5 -1 70 240.279 3
Lo Low (pH 4.5-6) 0.51 3.23 -14.56 1 5 0 67 241.287 3

Vendor Notes

Note Type Comments Provided By
MP 150 - 152 Enamine Building Blocks
MP 150...152 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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