UCSF

ZINC62566874

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2011 13 Yes

Other Names:

MFCD19285327

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) 0.99 4.21 -45.23 2 3 1 37 183.275 1
Mid Mid (pH 6-8) 0.99 3.02 -7.43 1 3 0 32 182.267 1

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% )

No pre-computed analogs available. Try a structural similarity search.