UCSF

ZINC37756701

Substance Information

In ZINC since Heavy atoms Benign functionality
November 30th, 2009 16 Yes

Other Names:

MFCD12768724

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) 0.94 6.07 -80.21 3 4 2 47 222.336 2
Mid Mid (pH 6-8) 0.94 5.68 -44.95 2 4 1 46 221.328 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% )