UCSF

ZINC34479370

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 13 Yes

Other Names:

MFCD09908826

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) 1.70 4.24 -26.19 4 3 1 56 174.227 1
Mid Mid (pH 6-8) 1.70 4.26 -6.95 3 3 0 55 173.219 1
Mid Mid (pH 6-8) 1.70 4.26 -6.65 3 3 0 55 173.219 1

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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