UCSF

ZINC65528309

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 25 Yes

Popular Name: (3aS,7R)-7-(3-methoxyphenyl)-2-pyrimidin-4-yl-5,6,7,8-tetrahydro-3aH-imidazo[4,5-c]azepin-4-one (3aS,7R)-7-(3-methoxyphenyl)-2-p…

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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) 1.81 4.84 -17.37 2 7 0 93 335.367 3 ↓
Lo Low (pH 4.5-6) 1.81 5.27 -35.65 3 7 1 94 336.375 3 ↓

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

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