UCSF

ZINC37837231

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 21 Yes

Popular Name: 4-[[(9aR)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl]sulfonyl]-1H-pyrrole-2-carboxylic 4-[[(9aR)-1,3,4,6,7,8,9,9a-octah…

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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) 0.69 4.25 -67.97 2 7 0 98 313.379 3 ↓
Mid Mid (pH 6-8) 0.69 2 -50.4 1 7 -1 97 312.371 3 ↓

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