UCSF

ZINC19264408

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2008 21 Yes

Other Names:

MFCD09804624

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) 1.30 8.72 -57.1 1 4 -1 69 284.335 5
Lo Low (pH 4.5-6) 1.49 7.25 -46.42 2 4 0 74 285.343 5

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% )