UCSF

ZINC65164731

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2011 29 Yes

Popular Name: 1-methyl-3-[2-[4-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperazin-1-yl]ethyl]pyrrolo[2,3-b]pyridine 1-methyl-3-[2-[4-(1,3,5-trimethy…

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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) 1.09 6.53 -17.16 0 8 0 76 416.551 5 ↓
Mid Mid (pH 6-8) 1.09 8.73 -61.05 1 8 1 77 417.559 5 ↓

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

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