UCSF

ZINC12403717

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 12th, 2008 24 No

Popular Name: N'-(6-bromo-5-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-methoxybenzohydrazide N'-(6-bromo-5-methyl-2-oxo-1,2-d…

Find On: PubMed — Wikipedia — Google

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) 3.55 5.08 -10.22 2 6 0 84 388.221 3 ↓
Hi High (pH 8-9.5) 4.01 3.34 -43.19 1 6 -1 87 387.213 3 ↓
Hi High (pH 8-9.5) 4.01 3.03 -53.7 1 6 -1 87 387.213 3 ↓

Activity (Go SEA)

Rings

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

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