UCSF

ZINC20259929

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2008 11 Yes

Other Names:

MFCD11172862

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) 1.76 5.64 -52.59 0 2 -1 40 151.185 3
Lo Low (pH 4.5-6) 1.76 4.54 -6.35 1 2 0 37 152.193 3

Vendor Notes

Note Type Comments Provided By
MP 134 - 136 Enamine Building Blocks
MP 134...136 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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