UCSF

ZINC72307578

Substance Information

In ZINC since Heavy atoms Benign functionality
May 17th, 2012 13 Yes

Other Names:

MFCD22056472

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) 0.28 2.05 -111.58 4 3 2 41 186.299 3
Mid Mid (pH 6-8) 0.28 0.01 -32.49 3 3 1 40 185.291 3
Mid Mid (pH 6-8) 0.28 0.72 -31.13 3 3 1 37 185.291 3

Vendor Notes

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

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