UCSF

ZINC37084361

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 18 Yes

Popular Name: (7S,8S)-N7-cyclopentyl-N7-methyl-1,4-dioxaspiro[4.5]decane-7,8-diamine (7S,8S)-N7-cyclopentyl-N7-methyl…

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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) 1.14 4.48 -119.42 4 4 2 51 256.39 2 ↓
Hi High (pH 8-9.5) 1.14 2.6 -41.38 3 4 1 49 255.382 2 ↓
Hi High (pH 8-9.5) 1.14 4.17 -31.88 3 4 1 49 255.382 2 ↓

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