UCSF

ZINC53631721

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 28 Yes

Popular Name: (4S)-2-(1,3-benzothiazol-2-yl)-3-hydroxy-5-[2-(1H-imidazol-5-yl)ethyl]-4-methyl-4,7-dihydropyrazolo[ (4S)-2-(1,3-benzothiazol-2-yl)-3…

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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) 2.01 9.15 -49.64 3 8 1 101 395.468 4 ↓
Mid Mid (pH 6-8) 2.01 8.69 -25.29 2 8 0 100 394.46 4 ↓

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

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