UCSF

ZINC04325984

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2005 33 No

Popular Name: 4-[(3,4-dimethoxyphenyl)-hydroxy-methylene]-5-(3-methoxyphenyl)-1-(5-methylisoxazol-3-yl)-pyrrolidin 4-[(3,4-dimethoxyphenyl)-hydroxy…

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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) 2.58 8.08 -56.14 0 9 -1 114 449.439 7 ↓
Lo Low (pH 4.5-6) 2.58 7.33 -16.06 1 9 0 111 450.447 7 ↓

Activity (Go SEA)

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