UCSF

ZINC65526562

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 21 No

Popular Name: (3R)-3-[(3S)-5-cyclopropyl-2-(2-methyl-4-pyridyl)-3,4-dihydro-1,2,4-triazol-3-yl]-3H-1,2,4-triazol-5 (3R)-3-[(3S)-5-cyclopropyl-2-(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) 0.54 5.44 -11.91 4 8 0 108 284.327 3 ↓
Mid Mid (pH 6-8) 0.54 5.88 -30.09 5 8 1 109 285.335 3 ↓

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

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