UCSF

ZINC13284235

Substance Information

In ZINC since Heavy atoms Benign functionality
June 14th, 2008 15 Yes

Other Names:

MFCD01570452

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) 2.12 5.97 -47.17 0 3 -1 53 200.217 3
Lo Low (pH 4.5-6) 2.12 6.25 -58.38 1 3 0 54 201.225 3

Vendor Notes

Note Type Comments Provided By
MP 197 - 199 Enamine Building Blocks
MP 197...199 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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Analogs ( Draw Identity 99% 90% 80% 70% )