UCSF

ZINC70190172

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2011 19 Yes

Popular Name: 2-[1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-4-piperidyl]-N-methyl-ethanamine 2-[1-(6,7-dihydro-5H-cyclopenta[…

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) 2.12 8.63 -77.2 3 4 2 47 262.401 4 ↓
Mid Mid (pH 6-8) 2.12 8.19 -43.17 2 4 1 46 261.393 4 ↓

Activity (Go SEA)

Rings

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

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