UCSF

ZINC62770005

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 11th, 2011 20 Yes

Popular Name: N-[(1R)-2-(2-furyl)-1-methyl-ethyl]-2,2-dimethyl-1,3-benzodioxol-5-amine N-[(1R)-2-(2-furyl)-1-methyl-eth…

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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) 4.55 7.04 -8.19 1 4 0 44 273.332 4 ↓
Lo Low (pH 4.5-6) 4.55 7.28 -39.33 2 4 1 48 274.34 4 ↓

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

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