UCSF

ZINC67073389

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2011 27 No

Popular Name: (2R)-2-(2-cyanophenoxy)-N-[2-(4-isopropyl-5-sulfanyl-1,2,4-triazol-3-yl)ethyl]-3-methyl-butanamide (2R)-2-(2-cyanophenoxy)-N-[2-(4-…

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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) 2.07 10.03 -33.38 2 7 0 96 387.509 8 ↓
Mid Mid (pH 6-8) 2.80 9.98 -64.38 1 7 -1 93 386.501 8 ↓

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

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