UCSF

ZINC19883760

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 15 Yes

Other Names:

MFCD11139957

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) 3.14 5.59 -33.95 2 2 1 20 213.389 6
Lo Low (pH 4.5-6) 3.14 7.94 -100.38 3 2 2 21 214.397 6

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% )