UCSF

ZINC22115525

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 21 Yes

Popular Name: 1,4-bis(3-methyl-2-pyridyl)-1,4-diazepane 1,4-bis(3-methyl-2-pyridyl)-1,4-…

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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) 2.90 8.55 -76.46 2 4 2 35 284.407 2 ↓
Hi High (pH 8-9.5) 2.90 7.72 -6.58 0 4 0 32 282.391 2 ↓
Mid Mid (pH 6-8) 2.90 8.12 -33.21 1 4 1 34 283.399 2 ↓

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