UCSF

ZINC65156023

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2011 23 Yes

Popular Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[2-(4-methylpiperazin-1-yl)eth…

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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) 0.46 5.96 -47.3 2 6 1 55 316.429 5 ↓
Hi High (pH 8-9.5) 0.46 3.59 -15.55 1 6 0 53 315.421 5 ↓

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

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