UCSF

ZINC19995411

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 27 No

Popular Name: (5Z)-5-[(morpholinoamino)methylene]-2-thioxo-1-[3-(trifluoromethyl)phenyl]hexahydropyrimidine-4,6-di (5Z)-5-[(morpholinoamino)methyle…

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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) 1.55 4.88 -43.93 1 7 -1 82 399.374 4 ↓
Lo Low (pH 4.5-6) 1.09 5.95 -11.52 2 7 0 79 400.382 4 ↓

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

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