UCSF

ZINC34937280

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 14 Yes

Other Names:

MFCD10693507

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) 1.45 7.49 -47.33 2 3 1 34 194.302 5
Mid Mid (pH 6-8) 1.45 8 -93.7 3 3 2 36 195.31 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% )