UCSF

ZINC36724035

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2009 16 Yes

Other Names:

MFCD11164621

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) 0.94 -0.89 -46.05 1 6 -1 94 256.288 3
Lo Low (pH 4.5-6) 0.94 -0.95 -13.88 2 6 0 92 257.296 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% )