UCSF

ZINC35602160

Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2009 18 Yes

Other Names:

MFCD12421496

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) 1.61 4.29 -34.98 3 3 1 37 249.378 5
Lo Low (pH 4.5-6) 1.61 5.37 -107.86 4 3 2 41 250.386 5

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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