UCSF

ZINC19470639

Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2008 15 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) 0.39 4.91 -30.96 4 4 1 68 205.285 2
Mid Mid (pH 6-8) 0.39 4.18 -8.51 3 4 0 66 204.277 2

Vendor Notes

Note Type Comments Provided By
MP 275 - 277 Enamine Building Blocks
MP 275...277 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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