UCSF

ZINC69665231

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2011 19 Yes

Popular Name: N,N-dimethyl-1-[(2S)-4-thieno[3,2-d]pyrimidin-4-ylmorpholin-2-yl]methanamine N,N-dimethyl-1-[(2S)-4-thieno[3,…

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) 1.39 6.81 -42.59 1 5 1 43 279.389 3 ↓
Hi High (pH 8-9.5) 1.39 4.29 -8.37 0 5 0 41 278.381 3 ↓
Lo Low (pH 4.5-6) 1.39 7.3 -78.26 2 5 2 44 280.397 3 ↓

Activity (Go SEA)

Rings

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