UCSF

ZINC19508744

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 14 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) 1.04 5.24 -25.4 1 3 0 57 204.616 0
Mid Mid (pH 6-8) 2.34 4.83 -30.37 0 3 -1 60 203.608 0

Vendor Notes

Note Type Comments Provided By
MP 381 - 383 Enamine Building Blocks
MP 381...383 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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