UCSF

ZINC34939710

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 10 Yes

Other Names:

MFCD10693484

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) 1.23 1.27 -7.07 2 3 0 52 138.17 1
Lo Low (pH 4.5-6) 1.23 1.27 -25.72 3 3 1 53 139.178 1

Vendor Notes

Note Type Comments Provided By
MP 55 - 57 Enamine Building Blocks
MP 55...57 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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