UCSF

ZINC14141373

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 3rd, 2008 30 No

Popular Name: (4R)-4-tridecyl-1,5,9,13-tetrazacyclohexadecan-2-one (4R)-4-tridecyl-1,5,9,13-tetraza…

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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) 6.72 11.3 -208.63 7 5 3 79 427.742 12 ↓
Hi High (pH 8-9.5) 6.72 8.87 -40.75 5 5 1 70 425.726 12 ↓
Mid Mid (pH 6-8) 6.72 10.25 -107.47 6 5 2 74 426.734 12 ↓
Mid Mid (pH 6-8) 6.72 9.92 -104.98 6 5 2 74 426.734 12 ↓

Activity (Go SEA)

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