UCSF

ZINC69950901

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 29 Yes

Popular Name: N4-(2-ethylphenyl)-6-[[(2S)-2-phenylmorpholin-4-yl]methyl]-1,3,5-triazine-2,4-diamine N4-(2-ethylphenyl)-6-[[(2S)-2-ph…

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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) 3.62 11.72 -7.71 3 7 0 89 390.491 6 ↓
Lo Low (pH 4.5-6) 3.62 13.99 -38.36 4 7 1 90 391.499 6 ↓
Lo Low (pH 4.5-6) 3.62 12.29 -31.06 4 7 1 90 391.499 6 ↓

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

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