UCSF

ZINC44659158

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2010 13 Yes

Other Names:

MFCD28246511

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) 0.13 0.95 -42.8 3 3 1 40 187.307 5
Mid Mid (pH 6-8) 0.13 2.86 -35.06 3 3 1 40 187.307 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% )