UCSF

ZINC64543172

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2011 18 Yes

Popular Name: N,N-dimethylpyrido[3,2-b][1,4]benzoxazepin-6-amine N,N-dimethylpyrido[3,2-b][1,4]be…

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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) 2.80 7.28 -28.78 1 4 1 43 240.286 1 ↓
Mid Mid (pH 6-8) -1.24 7.78 -84.95 2 4 2 46 241.294 0 ↓
Lo Low (pH 4.5-6) -1.24 7.3 -26.79 1 4 1 45 240.286 0 ↓

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Rings

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

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