UCSF

ZINC37020912

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2009 16 Yes

Other Names:

MFCD12126262

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) 2.38 3.76 -43.11 4 3 1 57 261.798 5
Hi High (pH 8-9.5) 2.38 3.43 -5.32 3 3 0 55 260.79 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% )