UCSF

ZINC19840630

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 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) -0.52 -1.19 -45.42 3 4 1 43 214.333 3
Mid Mid (pH 6-8) -0.52 1.14 -91.28 4 4 2 45 215.341 3

Vendor Notes

Note Type Comments Provided By
MP 306 - 308 Enamine Building Blocks
MP 306...308 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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