UCSF

ZINC18080692

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2008 30 No

Popular Name: (3R,3aR,6aS)-5-(4-ethoxyphenyl)-2-phenyl-3-(2-thienyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6- (3R,3aR,6aS)-5-(4-ethoxyphenyl)-…

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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) 4.36 10.79 -13.44 0 6 0 59 420.49 5 ↓
Ref Reference (pH 7) 4.36 10.53 -8.74 0 6 0 59 420.49 5 ↓

Activity (Go SEA)

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