UCSF

ZINC37483499

Substance Information

In ZINC since Heavy atoms Benign functionality
November 25th, 2009 16 Yes

Other Names:

MFCD12164796

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) 1.15 4.07 -39.68 2 3 1 33 220.34 4
Lo Low (pH 4.5-6) 1.15 4.41 -78.02 3 3 2 34 221.348 4
Lo Low (pH 4.5-6) 1.15 6.29 -102.57 3 3 2 34 221.348 4

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% )