UCSF

ZINC67946973

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 22 Yes

Popular Name: 3,7-dimethyl-11-[(6-methyl-2-pyridyl)methyl]-3,7,11-triazaspiro[5.6]dodecane 3,7-dimethyl-11-[(6-methyl-2-pyr…

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Download: MOL2 SDF SMILES Flexibase

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) 1.28 9.01 -100.56 2 4 2 25 304.482 2 ↓
Mid Mid (pH 6-8) 1.28 7.27 -39.96 1 4 1 24 303.474 2 ↓

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

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