UCSF

ZINC01383891

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 22 Yes

Popular Name: 2-benzyl-5,6-dihydrobenzo[h]cinnolin-3(2H)-one 2-benzyl-5,6-dihydrobenzo[h]cinn…

Find On: PubMed — Wikipedia — Google

CAS Number: 31384-38-0

Other Names:

MFCD03012031

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) 3.51 10.15 -9.43 0 3 0 35 288.35 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 90 - 93 KeyOrganics

Activity (Go SEA)

Rings

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

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