UCSF

ZINC49568156

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 17 Yes

Popular Name: (1R,8R)-N-[(5-chloro-1-methyl-imidazol-2-yl)methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine (1R,8R)-N-[(5-chloro-1-methyl-im…

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Vendors

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) 1.00 6.81 -113.77 3 4 2 39 256.781 3 ↓
Hi High (pH 8-9.5) 1.00 3.38 -5.61 1 4 0 33 254.765 3 ↓
Mid Mid (pH 6-8) 1.00 5.87 -38.79 2 4 1 34 255.773 3 ↓
Lo Low (pH 4.5-6) 1.00 6.33 -81.66 3 4 2 36 256.781 3 ↓

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

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