UCSF

ZINC20469718

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2008 16 Yes

Other Names:

MFCD11191685

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) 0.34 0.41 -53.09 4 3 1 51 225.287 2
Hi High (pH 8-9.5) 0.34 0.02 -7.27 3 3 0 49 224.279 2

Vendor Notes

Note Type Comments Provided By
MP 104 - 106 Enamine Building Blocks
MP 104...106 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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