UCSF

ZINC37390589

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 12 Yes

Other Names:

MFCD12148600

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) 1.82 5.01 -35.66 2 3 1 43 174.264 5
Mid Mid (pH 6-8) 1.82 3.82 -3.91 1 3 0 38 173.256 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% )