UCSF

ZINC67974733

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 25 Yes

Popular Name: (5R)-1-isobutyl-5-[methyl-[(4-methylthiadiazol-5-yl)methyl]amino]-4,5,6,7-tetrahydroindazole-3-carbo (5R)-1-isobutyl-5-[methyl-[(4-me…

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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) 2.45 6.79 -61.76 0 7 -1 87 362.479 6 ↓
Lo Low (pH 4.5-6) 2.45 8.71 -78.7 1 7 0 88 363.487 6 ↓

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

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