UCSF

ZINC61360754

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 18 Yes

Popular Name: N-[(1R)-1-(3-thienyl)ethyl]-1,4-dioxaspiro[4.5]decan-8-amine N-[(1R)-1-(3-thienyl)ethyl]-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) 2.45 6.05 -39.13 2 3 1 35 268.402 3 ↓
Hi High (pH 8-9.5) 2.45 5.09 -4.31 1 3 0 30 267.394 3 ↓

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

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