UCSF

ZINC31983517

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 19th, 2009 38 No

Popular Name: CR 725; Hydrocinnamamide, alpha-((p-chlorobenzoyl)amino)-N,N-dipropyl-4-(3-(4-methyl-1-piperazinyl)propoxy)-, citrate, (+-)-; LS-77095; O-(3-(N''-Methylpiperazine)-N'-propyl)-N-(p-chlorobenzoyl)-DL-tyrosyldi-n-propylamide citrate CR 725; 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) 4.96 13.57 -47.11 2 7 1 66 544.16 14 ↓
Hi High (pH 8-9.5) 4.96 11.2 -15.23 1 7 0 65 543.152 14 ↓

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