UCSF

ZINC20268158

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 23 Yes

Other Names:

MFCD06660803

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) 0.49 8.4 -70.74 3 6 0 99 317.389 5
Mid Mid (pH 6-8) 0.49 7.9 -55.24 2 6 -1 98 316.381 5
Mid Mid (pH 6-8) 0.49 7.84 -66.06 2 6 -1 98 316.381 5

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% )