UCSF

ZINC58333221

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 25 Yes

Popular Name: N-[(1S)-1-[[3-(dimethylamino)phenyl]methylcarbamoyl]-2-methyl-propyl]furan-2-carboxamide N-[(1S)-1-[[3-(dimethylamino)phe…

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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) 2.08 5.82 -9.33 2 6 0 75 343.427 7 ↓
Lo Low (pH 4.5-6) 2.08 6.51 -25.01 3 6 0 76 344.435 7 ↓

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

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