UCSF

ZINC05883896

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 18th, 2006 31 No

Popular Name: 4-amino-2-(4-isopropylphenyl)-9-(4-propoxyphenyl)-5-oxa-7,8-diazabicyclo[4.3.0]nona-3,6,9-triene-3-c 4-amino-2-(4-isopropylphenyl)-9-…

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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) 5.34 7.46 -8.27 3 6 0 97 414.509 6 ↓
Ref Reference (pH 7) 5.34 8.05 -8.35 3 6 0 97 414.509 6 ↓
Lo Low (pH 4.5-6) 5.34 8.33 -55.68 4 6 1 99 415.517 6 ↓

Activity (Go SEA)

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