UCSF

ZINC03888760

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 16 No

Other Names:

MFCD06655568

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) 0.76 0.72 -45.71 0 5 -1 60 259.332 2
Lo Low (pH 4.5-6) 0.76 0.18 -9.65 0 5 0 60 260.34 2
Lo Low (pH 4.5-6) 0.03 1.09 -20.16 1 5 0 62 260.34 2

Vendor Notes

Note Type Comments Provided By
MP 71 - 73 Enamine Building Blocks
MP 71...73 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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Analogs ( Draw Identity 99% 90% 80% 70% )