UCSF

ZINC52540260

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 10th, 2010 17 Yes

Popular Name: [4-[[(4aS,7aR)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl]methyl]thiazol-2-yl]methanam [4-[[(4aS,7aR)-3,4a,5,6,7,7a-hex…

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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) 0.56 0.57 -45.12 3 4 1 53 254.379 3 ↓
Mid Mid (pH 6-8) 0.56 2.67 -96.81 4 4 2 54 255.387 3 ↓
Mid Mid (pH 6-8) 0.56 0.16 -6.08 2 4 0 51 253.371 3 ↓

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

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