UCSF

ZINC44135801

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2010 16 Yes

Other Names:

MFCD22392013

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) 2.18 6.44 -44.72 2 3 1 43 220.292 3
Hi High (pH 8-9.5) 2.18 5.18 -6.88 1 3 0 38 219.284 3

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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