UCSF

ZINC04206217

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 16 No

Other Names:

MFCD06655682

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) 0.29 -1.56 -35.27 0 6 -1 84 219.176 2
Mid Mid (pH 6-8) -0.16 1.12 -6.45 1 6 0 81 220.184 2

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% )