UCSF

ZINC37225760

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 20 Yes

Popular Name: 1-[(2S)-3-(cyclopropylamino)-2-hydroxy-propyl]-7-fluoro-3,4-dihydroquinolin-2-one 1-[(2S)-3-(cyclopropylamino)-2-h…

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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) 0.85 5.46 -39.09 3 4 1 57 279.335 5 ↓
Hi High (pH 8-9.5) 0.85 4.12 -7.83 2 4 0 53 278.327 5 ↓

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

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