UCSF

ZINC72322805

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 15th, 2012 28 Yes

Popular Name: N2,N2,1-trimethyl-N6-(4-methyl-1,3-benzothiazol-2-yl)pyrrolo[3,2-b]pyridine-2,6-dicarboxamide N2,N2,1-trimethyl-N6-(4-methyl-1…

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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) 2.83 7.5 -16.1 1 7 0 80 393.472 3 ↓
Lo Low (pH 4.5-6) 2.83 7.96 -49.72 2 7 1 81 394.48 3 ↓

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

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