UCSF

ZINC03344800

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2005 18 No

Other Names:

MFCD04612888

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) -0.34 1.2 -46.21 4 7 1 93 272.354 3
Mid Mid (pH 6-8) -0.34 -1.16 -10.89 3 7 0 92 271.346 3

Vendor Notes

Note Type Comments Provided By
MP 168 - 170 Enamine Building Blocks
MP 168...170 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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