UCSF

ZINC67740933

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 14th, 2011 25 Yes

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

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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) 3.52 13.46 -91.79 3 5 2 47 339.487 5 ↓
Hi High (pH 8-9.5) 3.52 10.94 -8.38 1 5 0 44 337.471 5 ↓
Mid Mid (pH 6-8) 3.52 11.23 -25.22 2 5 1 46 338.479 5 ↓

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

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