UCSF

ZINC00088302

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2005 17 Yes

Other Names:

MFCD01566978

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) 1.25 7.29 -66.62 0 5 -1 75 229.215 2
Lo Low (pH 4.5-6) 1.25 6.49 -31.66 1 5 0 78 230.223 2

Vendor Notes

Note Type Comments Provided By
MP 167 - 169 Enamine Building Blocks
MP 167...169 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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