UCSF

ZINC53629001

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 18 No

Popular Name: (2R,3S)-3-bromo-2-[[(2R)-4-methyl-2H-imidazol-2-yl]sulfanylmethyl]-3,6-dihydro-2H-imidazo[1,2-a]pyri (2R,3S)-3-bromo-2-[[(2R)-4-methy…

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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) 1.43 6.58 -15.23 1 5 0 59 326.223 3 ↓
Lo Low (pH 4.5-6) 1.43 6.98 -32.06 2 5 1 60 327.231 3 ↓

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

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