UCSF

ZINC20282172

Substance Information

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

Other Names:

MFCD08442501

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) 2.19 2.82 -10.45 1 4 0 46 276.361 3
Lo Low (pH 4.5-6) 2.19 3.2 -27.53 2 4 1 47 277.369 3

Vendor Notes

Note Type Comments Provided By
MP 118 - 120 Enamine Building Blocks
MP 118...120 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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