UCSF

ZINC58331077

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 18 Yes

Popular Name: N2-methyl-N5-thieno[3,2-d]pyrimidin-4-yl-pyridine-2,5-diamine N2-methyl-N5-thieno[3,2-d]pyrimi…

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) 2.54 5.59 -9.28 2 5 0 63 257.322 3 ↓
Mid Mid (pH 6-8) 2.54 6.06 -33.7 3 5 1 64 258.33 3 ↓

Activity (Go SEA)

Rings

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

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