UCSF

ZINC62668390

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 5th, 2011 16 Yes

Popular Name: N-isopropyl-4,5-dihydro-2H-thieno[2,3-g]indazol-3-amine N-isopropyl-4,5-dihydro-2H-thien…

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) 2.62 6.04 -7.52 2 3 0 41 233.34 2 ↓
Lo Low (pH 4.5-6) 2.62 6.16 -25.06 3 3 1 42 234.348 2 ↓

Activity (Go SEA)

Rings

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

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