UCSF

ZINC36873054

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 17 Yes

Other Names:

MFCD12105297

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) 1.50 5.22 -43.28 3 3 1 48 239.314 5
Hi High (pH 8-9.5) 1.50 4.89 -7.39 2 3 0 46 238.306 5

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

Rings

Analogs ( Draw Identity 99% 90% 80% 70% )