UCSF

ZINC20284367

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 18 No

Other Names:

MFCD08444760

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) 2.13 6.33 -12.07 0 4 0 48 243.262 5
Lo Low (pH 4.5-6) 2.13 6.77 -38.83 1 4 1 50 244.27 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% )