UCSF

ZINC65508767

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2011 23 Yes

Popular Name: (8R)-2-(dimethylamino)-8-(2,4,5-trimethylphenyl)-4,5,7,8-tetrahydrothiazolo[4,5-c]azepin-6-one (8R)-2-(dimethylamino)-8-(2,4,5-…

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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) 3.35 7.8 -9.37 1 4 0 45 329.469 2 ↓
Lo Low (pH 4.5-6) 3.35 8.22 -34.22 2 4 1 46 330.477 2 ↓

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

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