UCSF

ZINC03647608

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 27 Yes

Popular Name: [9-amino-2-(4-chlorophenyl)-4-cyclopropyl-7-thia-5-azabicyclo[4.3.0]nona-2,4,8,10-tetraen-8-yl]-(2-t [9-amino-2-(4-chlorophenyl)-4-cy…

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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) 6.22 -1.68 -8.64 2 3 0 55 410.951 4 ↓
Lo Low (pH 4.5-6) 6.22 -1.63 -32.96 3 3 1 57 411.959 4 ↓

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.