UCSF

ZINC65356268

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 11th, 2011 32 No

Popular Name: N-[(7aR)-7aH-indazol-6-yl]-2-[[(3R,5S)-4-(p-tolyl)-5-(4-pyridyl)-1,2,4-triazolidin-3-yl]sulfanyl]ace N-[(7aR)-7aH-indazol-6-yl]-2-[[(…

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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) 2.61 4.9 -13.65 3 8 0 94 445.552 6 ↓
Mid Mid (pH 6-8) 2.61 5.36 -51.76 4 8 1 95 446.56 6 ↓

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

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