UCSF

ZINC37379212

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 15 Yes

Other Names:

MFCD03002278

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) 3.35 6.61 -43.13 3 1 1 28 198.289 2
Hi High (pH 8-9.5) 3.35 6.39 -3.26 2 1 0 26 197.281 2

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% )