UCSF

ZINC63743447

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 5th, 2011 30 No

Popular Name: N-[(2R)-5-[[(3S)-3,5-dimethyl-3H-pyrazol-4-yl]sulfonylamino]-2,3-dihydro-1,3-benzothiazol-2-yl]-4-me N-[(2R)-5-[[(3S)-3,5-dimethyl-3H…

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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) 3.27 2.55 -40.06 2 8 -1 114 442.546 5 ↓
Mid Mid (pH 6-8) 3.27 1.84 -15.1 3 8 0 112 443.554 5 ↓

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

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