UCSF

ZINC31978689

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 17 Yes

Other Names:

MFCD11892500

MFCD19313129

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) 1.59 6.79 -78.24 1 4 0 54 235.283 3
Hi High (pH 8-9.5) 1.59 4.38 -48.77 0 4 -1 53 234.275 3

Vendor Notes

Note Type Comments Provided By
MP 218 - 220 Enamine Building Blocks
MP 218...220 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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