UCSF

ZINC12017287

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2008 24 No

Popular Name: (3R,3aR,6aR)-3-(4-methoxyphenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione (3R,3aR,6aR)-3-(4-methoxyphenyl)…

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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) 2.33 2.56 -39.85 0 6 -1 74 323.328 3 ↓
Ref Reference (pH 7) 2.33 2.48 -46.84 0 6 -1 74 323.328 3 ↓
Lo Low (pH 4.5-6) 2.15 5.11 -8.29 1 6 0 68 324.336 3 ↓

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