UCSF

ZINC04218436

Substance Information

In ZINC since Heavy atoms Benign functionality
November 15th, 2005 11 Yes

Other Names:

MFCD07345592

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) 0.90 -0.56 -41.63 0 5 -1 67 167.173 1
Lo Low (pH 4.5-6) 0.90 -1.38 -8.45 1 5 0 64 168.181 1

Vendor Notes

Note Type Comments Provided By
MP 151 - 153 Enamine Building Blocks
MP 151...153 Enamine Building Blocks
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.