UCSF

ZINC13571225

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 22nd, 2008 35 No

Popular Name: (4E,5R)-4-[(4-allyloxyphenyl)-hydroxy-methylene]-5-(3,4-dimethoxyphenyl)-1-(5-methylisoxazol-3-yl)py (4E,5R)-4-[(4-allyloxyphenyl)-hy…

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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) 3.25 10.03 -65.36 0 9 -1 114 475.477 9 ↓
Mid Mid (pH 6-8) 3.70 9.15 -25.45 1 9 0 111 476.485 8 ↓

Activity (Go SEA)

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