UCSF

ZINC22921438

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 13 Yes

Other Names:

MFCD08444502

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) 0.53 0.91 -42.83 3 3 1 40 187.307 2
Lo Low (pH 4.5-6) 0.53 2.82 -117.11 4 3 2 41 188.315 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% )