UCSF

ZINC05149615

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2006 29 No

Popular Name: 4-amino-9-(4-ethoxyphenyl)-2-(4-methylsulfanylphenyl)-5-oxa-7,8-diazabicyclo[4.3.0]nona-3,8,10-trien 4-amino-9-(4-ethoxyphenyl)-2-(4-…

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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) 3.76 6.39 -10.09 3 6 0 97 404.495 5 ↓
Lo Low (pH 4.5-6) 3.76 6.68 -59.35 4 6 1 99 405.503 5 ↓

Activity (Go SEA)

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