UCSF

ZINC34469617

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 17 Yes

Other Names:

MFCD11976259

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) 2.77 7.66 -5.84 0 3 0 30 233.311 2

Vendor Notes

Note Type Comments Provided By
bp 132 - 133 (p=2 torr) MolMall (formerly Molecular Diversity Preservation International)
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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