UCSF

ZINC05840173

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 17th, 2006 26 Yes

Popular Name: 5-(4-Chlorobenzoyl)-5,6,7,8,9,10-hexahydrocyclohepta(b)-1,3-dioxolo(4,5-f)indole; BRN 1038243; Cyclohepta(b)-1,3-dioxolo(4,5-f)indole, 5,6,7,8,9,10-hexahydro-5-(p-chlorobenzoyl)-; LS-55985 5-(4-Chlorobenzoyl)-5,6,7,8,9,10…

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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) 5.08 9.77 -13.04 1 4 0 51 367.832 2 ↓

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