UCSF

ZINC67954318

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 25 Yes

Popular Name: 11-[(E)-3-(2-methoxyphenyl)allyl]-3,7-dimethyl-3,7,11-triazaspiro[5.6]dodecane 11-[(E)-3-(2-methoxyphenyl)allyl…

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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) 3.17 9.23 -38.76 1 4 1 20 344.523 4 ↓
Mid Mid (pH 6-8) 3.17 10.65 -103.47 2 4 2 21 345.531 4 ↓

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

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