UCSF

ZINC38743709

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2010 25 No

Popular Name: N-(4-methoxyphenyl)-5-[(2R)-2-methyl-2H-indol-3-yl]-6H-1,3,4-thiadiazin-2-amine N-(4-methoxyphenyl)-5-[(2R)-2-me…

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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) 3.94 8.13 -26.61 2 5 1 60 351.455 4 ↓
Mid Mid (pH 6-8) 3.94 7.52 -15.15 1 5 0 62 350.447 4 ↓
Lo Low (pH 4.5-6) 3.94 7.77 -79.27 3 5 2 62 352.463 4 ↓

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

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