UCSF

ZINC38574001

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 33 No

Popular Name: (3S,4R)-4-hydroxy-N-[(E)-1-[(3R)-4-hydroxy-2-oxo-3H-quinolin-3-yl]ethylideneamino]-2-oxo-1-propyl-3, (3S,4R)-4-hydroxy-N-[(E)-1-[(3R)…

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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) 1.60 4.89 -47.48 4 9 1 133 449.487 5 ↓
Hi High (pH 8-9.5) 1.45 2.68 -53.89 4 9 0 139 448.479 5 ↓
Hi High (pH 8-9.5) 1.78 2.31 -64.64 3 9 0 140 448.479 5 ↓

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

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