UCSF

ZINC22145567

Substance Information

In ZINC since Heavy atoms Benign functionality
December 13th, 2008 17 Yes

Other Names:

MFCD09049440

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) 2.91 7.03 -65.96 0 3 -1 53 222.223 1
Lo Low (pH 4.5-6) 2.91 7.22 -42.43 1 3 0 54 223.231 1

Vendor Notes

Note Type Comments Provided By
MP 200 - 202 Enamine Building Blocks
MP 200...202 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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