UCSF

ZINC40290794

Substance Information

In ZINC since Heavy atoms Benign functionality
April 5th, 2010 16 No

Other Names:

MFCD12790599

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) 1.58 4.38 -13.36 2 4 0 55 236.344 2
Lo Low (pH 4.5-6) 1.58 4.51 -31.1 3 4 1 56 237.352 2

Vendor Notes

Note Type Comments Provided By
MP 169 - 171 Enamine Building Blocks
MP 169...171 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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