UCSF

ZINC37729934

Substance Information

In ZINC since Heavy atoms Benign functionality
November 30th, 2009 13 Yes

Other Names:

MFCD12804802

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) 2.17 4.72 -41.42 3 3 1 54 188.291 6
Mid Mid (pH 6-8) 2.17 4.41 -2.76 2 3 0 52 187.283 6

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% )