UCSF

ZINC37815474

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 18 Yes

Popular Name: 1-[(4aS,8aR)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]-2-[[(1S)-1-methylpropyl]amino]etha 1-[(4aS,8aR)-2,3,4a,5,6,7,8,8a-o…

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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) 1.89 5.49 -39.66 2 4 1 46 255.382 4 ↓
Hi High (pH 8-9.5) 1.89 4.29 -7.32 1 4 0 42 254.374 4 ↓

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