UCSF

ZINC68958185

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 16th, 2011 16 Yes

Popular Name: 2-(4-tetrahydropyran-4-yl-1,4-diazepan-1-yl)ethanol 2-(4-tetrahydropyran-4-yl-1,4-di…

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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) 0.25 1.02 -31.76 2 4 1 37 229.344 3 ↓
Lo Low (pH 4.5-6) 0.25 3.23 -106.2 3 4 2 38 230.352 3 ↓

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

No pre-computed analogs available. Try a structural similarity search.