UCSF

ZINC00025958

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2005 24 Yes

Popular Name: AG-014699 AG-014699

Find On: PubMed — Wikipedia — Google

CAS Numbers: 283173-50-2 , 459868-92-9 , [283173-50-2] , [459868-92-9]

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) 2.62 -3 -54.45 4 4 1 61 324.379 3 ↓

Vendor Notes

Note Type Comments Provided By
Target PARP Selleck Chemicals

Activity (Go SEA)

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

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