UCSF

ZINC34621604

Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 10 Yes

Other Names:

MFCD13175896

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) 1.86 5.49 -3.75 0 1 0 13 133.194 3
Lo Low (pH 4.5-6) 1.86 5.84 -28.98 1 1 1 14 134.202 3

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% )