UCSF

ZINC37075146

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 21 Yes

Popular Name: (1R)-N-[(R)-cyclopropyl(phenyl)methyl]-1-(4-methylsulfanylphenyl)ethanamine (1R)-N-[(R)-cyclopropyl(phenyl)m…

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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) 4.94 11.72 -39.31 2 1 1 17 298.475 6 ↓
Hi High (pH 8-9.5) 4.94 10.9 -3.37 1 1 0 12 297.467 6 ↓

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