UCSF

ZINC34048998

Substance Information

In ZINC since Heavy atoms Benign functionality
August 9th, 2009 35 Yes

CAS Numbers: 371942-69-7 , [371942-69-7]

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) 2.71 4.42 -24.46 3 10 0 132 467.489 4
Lo Low (pH 4.5-6) 2.71 4.89 -61.21 4 10 1 134 468.497 4

Vendor Notes

Note Type Comments Provided By
Target PI3K Selleck Chemicals

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.