UCSF

ZINC51112977

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2010 23 Yes

Popular Name: 1-[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]-2-(3,4-dihydro-1H-isoquinolin-2-yl 1-[(4aS,8aS)-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) 2.32 6.96 -9.32 0 4 0 33 314.429 2 ↓
Mid Mid (pH 6-8) 2.32 9.16 -43.63 1 4 1 34 315.437 2 ↓

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