UCSF

ZINC67490149

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2011 25 Yes

Popular Name: (2S,4S)-4-amino-1-(3-fluoro-7-methyl-imidazo[1,2-a]pyridine-2-carbonyl)-N-isopropyl-pyrrolidine-2-ca (2S,4S)-4-amino-1-(3-fluoro-7-me…

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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) 0.43 5.87 -68.65 4 7 1 94 348.402 3 ↓
Hi High (pH 8-9.5) 0.43 5.58 -21.46 3 7 0 93 347.394 3 ↓

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

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