UCSF

ZINC19995020

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 25 No

Popular Name: (5Z)-5-[(6-methyl-2-morpholino-3-quinolyl)methylene]-2-thioxo-thiazolidin-4-one (5Z)-5-[(6-methyl-2-morpholino-3…

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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) 2.93 5.34 -39.6 0 5 -1 61 370.479 2 ↓
Lo Low (pH 4.5-6) 2.93 5.73 -50.64 1 5 0 63 371.487 2 ↓
Lo Low (pH 4.5-6) 2.47 6.44 -9.58 1 5 0 58 371.487 2 ↓

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