UCSF

ZINC08567858

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2006 27 No

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

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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) 2.33 3.14 -11.84 3 7 0 106 380.429 4 ↓
Lo Low (pH 4.5-6) 2.33 3.41 -59.7 4 7 1 108 381.437 4 ↓

Activity (Go SEA)

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