UCSF

ZINC09271747

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 31 Yes

Popular Name: [3-amino-6-methyl-4-(2-thienyl)-5,6,7,8-tetrahydrothieno[2,3-b][1,6]naphthyridin-2-yl](1,3-benzodioxol-5-yl)methanone [3-amino-6-methyl-4-(2-thienyl)-…

Find On: PubMed — Wikipedia — Google

CAS Number: 354555-88-7

Other Names:

MFCD02168162

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 4.74 -2.38 -49.53 3 6 1 78 450.565 3 ↓
Lo Low (pH 4.5-6) 4.74 -2.34 -106.51 4 6 2 80 451.573 3 ↓

Activity (Go SEA)

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

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