UCSF

ZINC37238642

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 27 Yes

Popular Name: (3S,3aR,8aS,9aR)-3-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylmethyl)-5,8a-dimethyl-3,3a,7,8,9,9a-hexahydro (3S,3aR,8aS,9aR)-3-(1,4-dioxa-8-…

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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) 2.58 10.86 -43.98 1 5 1 49 374.501 2 ↓
Mid Mid (pH 6-8) 2.58 8.65 -10.92 0 5 0 48 373.493 2 ↓

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

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