UCSF

ZINC65492667

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2011 21 Yes

Popular Name: (4S)-4-[(4R)-2-ethyl-4-methyl-4H-imidazol-5-yl]-7-hydroxy-6-methyl-3,4-dihydro-1H-quinolin-2-one (4S)-4-[(4R)-2-ethyl-4-methyl-4H…

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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) 2.21 4.29 -33.69 4 5 1 79 286.355 2 ↓
Mid Mid (pH 6-8) 2.21 3.71 -14.34 3 5 0 78 285.347 2 ↓

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

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