UCSF

ZINC66074548

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 43 No

Popular Name: N4-[4-[(7-chloro-4-quinolyl)amino]phenyl]-N2-(3-morpholinopropyl)-N6-(o-tolyl)-1,3,5-triazine-2,4,6- N4-[4-[(7-chloro-4-quinolyl)amin…

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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) 7.96 18.54 -38.22 5 10 1 113 597.147 11 ↓
Mid Mid (pH 6-8) 7.96 20.82 -83.32 6 10 2 115 598.155 11 ↓
Mid Mid (pH 6-8) 7.96 18.12 -12.26 4 10 0 112 596.139 11 ↓
Mid Mid (pH 6-8) 7.96 20.39 -49.4 5 10 1 113 597.147 11 ↓

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

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