UCSF

ZINC70514935

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2011 20 Yes

Popular Name: (2S)-4-[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]-2-(isopropylamino)-2-methyl-b (2S)-4-[(4aS,8aS)-2,3,4a,5,6,7,8…

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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) 2.11 2.09 -33.59 3 4 1 49 285.452 6 ↓
Mid Mid (pH 6-8) 2.11 4.31 -97.49 4 4 2 51 286.46 6 ↓

Activity (Go SEA)

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