UCSF

ZINC09560094

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2007 26 Yes

Popular Name: 3-(4-bromophenyl)-4-(pyrrolidin-1-ylcarbonylmethylsulfanyl)-9-thia-3,5-diazabicyclo[4.3.0]nona-4,10- 3-(4-bromophenyl)-4-(pyrrolidin-…

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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) 3.14 -2.22 -18.19 0 5 0 55 452.399 4 ↓

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Rings

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

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