UCSF

ZINC23810739

Substance Information

In ZINC since Heavy atoms Benign functionality
January 8th, 2009 10 Yes

Other Names:

MFCD14627889

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) 0.19 1.2 -41.92 3 2 1 31 143.254 4
Mid Mid (pH 6-8) 0.19 3.31 -107.57 4 2 2 32 144.262 4
Mid Mid (pH 6-8) 0.19 2.65 -27.21 3 2 1 30 143.254 4

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% )