UCSF

ZINC35702160

Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2009 15 No

Other Names:

MFCD12191552

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) 0.47 3.73 -40.09 2 4 1 50 227.309 3
Mid Mid (pH 6-8) 0.47 2.5 -8.33 1 4 0 45 226.301 3

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% )