UCSF

ZINC02267166

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2004 31 No

CAS Numbers: 475110-96-4 , 956958-53-5 , [956958-53-5]

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) 5.26 -6.94 -15.14 2 8 0 109 448.533 5
Hi High (pH 8-9.5) 5.26 -6.58 -44.05 1 8 -1 111 447.525 5

Vendor Notes

Note Type Comments Provided By
Target PI3K Selleck Chemicals
Reactome Database Links REACT_147854 ChEBI

Activity (Go SEA)

Direct Reactome Annotations (via ChEBI)

Description Species
Constitutive PI3K/AKT Signaling in Cancer

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

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