UCSF

ZINC55053833

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 31 Yes

Popular Name: (2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)-[(3S)-3-[4-(o-tolyl)piperazin-1-yl]-1-piperidyl] (2-chloro-6,7-dihydro-5H-cyclope…

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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) 3.92 10.77 -12.45 0 5 0 40 439.003 3 ↓
Mid Mid (pH 6-8) 3.92 10.85 -39.31 1 5 1 41 440.011 3 ↓

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Rings

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

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