UCSF

ZINC69901648

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2011 25 Yes

Popular Name: 1H-indazol-4-yl-[4-[(6-methylpyridazin-3-yl)amino]-1-piperidyl]methanone 1H-indazol-4-yl-[4-[(6-methylpyr…

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) 1.06 5.68 -18.38 2 7 0 87 336.399 3 ↓
Mid Mid (pH 6-8) 1.06 5.77 -41.7 3 7 1 88 337.407 3 ↓
Mid Mid (pH 6-8) 1.06 5.71 -41.78 3 7 1 88 337.407 3 ↓

Activity (Go SEA)

Rings

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

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