UCSF

ZINC63959006

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 29 Yes

Popular Name: N-[6-[(2R)-2-methyl-1,2-dihydroimidazol-3-yl]-3-pyridyl]-4-morpholinosulfonyl-3H-pyrrole-2-carboxami N-[6-[(2R)-2-methyl-1,2-dihydroi…

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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) -0.21 0.65 -43.86 2 10 1 118 419.487 5 ↓
Hi High (pH 8-9.5) -0.02 -1.78 -50.56 0 10 -1 123 417.471 5 ↓
Mid Mid (pH 6-8) -0.21 0.21 -14.75 1 10 0 117 418.479 5 ↓

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

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