UCSF

ZINC32005836

Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 11 Yes

Other Names:

MFCD11500335

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) -0.04 0.66 -36.29 2 3 1 28 159.253 2
Mid Mid (pH 6-8) -0.04 -1.81 -2.9 1 3 0 27 158.245 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% )