UCSF

ZINC67974556

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 25 Yes

Popular Name: (7S)-7-(3-methoxyphenyl)-2-(3-methyl-1H-pyrazol-5-yl)-5,6,7,8-tetrahydro-1H-imidazo[4,5-c]azepin-4-o (7S)-7-(3-methoxyphenyl)-2-(3-me…

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Download: MOL2 SDF SMILES Flexibase

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) 2.34 3.77 -19.41 3 7 0 96 337.383 3 ↓
Lo Low (pH 4.5-6) 2.34 4.2 -38.07 4 7 1 97 338.391 3 ↓

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

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