UCSF

ZINC25463384

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2009 18 No

Popular Name: N-(5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)azepan-2-imine N-(5-methyl-6,7-dihydro-4H-thiaz…

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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) 2.51 4.04 -8.57 1 4 0 41 264.398 1 ↓
Ref Reference (pH 7) 2.51 4.99 -29.67 2 4 1 42 265.406 2 ↓
Mid Mid (pH 6-8) 2.51 8.06 -38.85 2 4 1 42 265.406 1 ↓
Lo Low (pH 4.5-6) 2.51 8.18 -78.85 3 4 2 43 266.414 2 ↓

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Rings

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

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