UCSF

ZINC36154251

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 27 Yes

Popular Name: 2-[(2-morpholinoethylamino)methyl]-5-(o-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one 2-[(2-morpholinoethylamino)methy…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 2.41 5.47 -60.65 3 6 1 75 385.513 6 ↓
Hi High (pH 8-9.5) 2.41 4.11 -12.35 2 6 0 70 384.505 6 ↓
Hi High (pH 8-9.5) 2.87 3.1 -47.14 2 6 0 78 384.505 6 ↓
Lo Low (pH 4.5-6) 2.41 6.38 -49.64 3 6 1 71 385.513 6 ↓

Activity (Go SEA)

Rings

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