UCSF

ZINC70514944

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2011 21 Yes

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

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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) 2.64 4.88 -34.2 3 4 1 49 299.479 7 ↓
Mid Mid (pH 6-8) 2.64 5.12 -96.54 4 4 2 51 300.487 7 ↓

Activity (Go SEA)

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