UCSF

ZINC35254327

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2009 18 Yes

Popular Name: (2S)-1-(2-furyl)-N-[(4-methylsulfanylphenyl)methyl]propan-2-amine (2S)-1-(2-furyl)-N-[(4-methylsul…

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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) 3.32 7.59 -4.86 1 2 0 25 261.39 6 ↓
Mid Mid (pH 6-8) 3.32 8.76 -39.74 2 2 1 30 262.398 6 ↓

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

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