UCSF

ZINC37440010

Substance Information

In ZINC since Heavy atoms Benign functionality
November 25th, 2009 18 Yes

Other Names:

MFCD12603594

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) 3.25 5.59 -10.25 1 3 0 38 242.253 1
Lo Low (pH 4.5-6) 3.25 6.01 -28.49 2 3 1 39 243.261 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% )