UCSF

ZINC37348615

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 21 Yes

Other Names:

MFCD13659552

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) 5.62 9.41 -4.73 3 3 0 55 348.288 4
Lo Low (pH 4.5-6) 5.62 9.54 -33.43 4 3 1 56 349.296 4

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% )