UCSF

ZINC17886764

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2008 28 No

Popular Name: (3S,3aR,6aS)-5-(m-tolyl)-2-phenyl-3-(2-thienyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione (3S,3aR,6aS)-5-(m-tolyl)-2-pheny…

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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) 4.35 10.9 -7.98 0 5 0 50 390.464 3 ↓
Ref Reference (pH 7) 4.35 11.15 -10.46 0 5 0 50 390.464 3 ↓

Activity (Go SEA)

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