UCSF

ZINC37460120

Substance Information

In ZINC since Heavy atoms Benign functionality
November 25th, 2009 9 Yes

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) 0.27 -1.77 -48.02 5 3 1 71 131.199 3
Hi High (pH 8-9.5) 0.27 -2.03 -6.42 4 3 0 69 130.191 3

Vendor Notes

Note Type Comments Provided By
MP 239 - 241 Enamine Building Blocks
MP 239...241 Enamine Building Blocks
MP 248 - 250 Enamine Building Blocks
MP 249 - 251 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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