UCSF

ZINC43388166

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 11 Yes

Other Names:

MFCD13249675

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) 2.27 4.97 -46.03 2 1 1 17 174.626 2
Hi High (pH 8-9.5) 2.27 3.53 -3.51 1 1 0 12 173.618 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% )