UCSF

ZINC60019694

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 32 Yes

Popular Name: (2S)-N-[(2R)-2-(dimethylamino)-2-phenyl-ethyl]-3-methyl-2-[[2-(2-naphthyl)acetyl]amino]butanamide (2S)-N-[(2R)-2-(dimethylamino)-2…

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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) 4.23 12.19 -46.33 3 5 1 63 432.588 9 ↓
Mid Mid (pH 6-8) 4.23 9.54 -10.01 2 5 0 61 431.58 9 ↓

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

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