UCSF

ZINC05197606

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 25th, 2006 28 No

Popular Name: 4-amino-2-(5-chloro-2-hydroxy-phenyl)-9-(3-methoxyphenyl)-5-oxa-7,8-diazabicyclo[4.3.0]nona-3,8,10-t 4-amino-2-(5-chloro-2-hydroxy-ph…

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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) 3.52 2.27 -10.72 4 7 0 117 394.818 3 ↓
Hi High (pH 8-9.5) 3.41 2.09 -39.61 2 7 -1 116 393.81 3 ↓
Lo Low (pH 4.5-6) 3.52 2.43 -56.2 5 7 1 119 395.826 3 ↓

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