UCSF

ZINC69489681

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 20 Yes

Popular Name: 4-(1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)quinazoline 4-(1-methyl-6,7-dihydro-4H-imida…

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) 0.89 10.15 -37.07 1 5 1 48 266.328 1 ↓
Hi High (pH 8-9.5) 0.89 9.68 -12.59 0 5 0 47 265.32 1 ↓
Lo Low (pH 4.5-6) 0.89 10.62 -83.51 2 5 2 49 267.336 1 ↓

Activity (Go SEA)

Rings

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

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