UCSF

ZINC38342095

Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2010 14 Yes

Other Names:

MFCD12913163

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) 1.75 0.68 -52.84 0 4 -1 62 206.25 1
Lo Low (pH 4.5-6) 1.29 2.4 -13.98 1 4 0 59 207.258 1

Vendor Notes

Note Type Comments Provided By
MP 267 - 269 Enamine Building Blocks
MP 267...269 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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

No pre-computed analogs available. Try a structural similarity search.