UCSF

ZINC38585632

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 26 Yes

Popular Name: 2-[(3S,4S)-4-methyl-7-(2-methylallyloxy)-2-oxo-chroman-3-yl]-N-[(3R)-3H-1,2,4-triazol-3-yl]acetamide 2-[(3S,4S)-4-methyl-7-(2-methyla…

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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) 2.22 10 -23.41 2 8 0 109 356.382 5 ↓
Mid Mid (pH 6-8) 2.23 9.53 -52.67 1 8 -1 113 355.374 6 ↓

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

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