UCSF

ZINC31983522

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 37 Yes

Popular Name: CR 727; Hydrocinnamamide, alpha-((p-chlorobenzoyl)amino)-N,N-dipropyl-4-(2-(diisopropylamino)-ethoxy)-, oxalate, (+-)-; LS-77093; O-(2'-Diisopropylaminoethyl)-N-(p-chlorobenzoyl)-DL-tyrosyl-di-n-propylamide oxalate CR 727; Hydrocinnamamide, alpha-…

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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) 6.14 15.46 -42.43 2 6 1 63 531.161 15 ↓
Hi High (pH 8-9.5) 6.14 13.7 -13.84 1 6 0 62 530.153 15 ↓

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