UCSF

ZINC69739515

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 23 Yes

Popular Name: 2-[[(3R)-4-(2-methoxyethyl)-3-methyl-piperazin-1-yl]methyl]-5,7-dimethyl-imidazo[1,2-a]pyrimidine 2-[[(3R)-4-(2-methoxyethyl)-3-me…

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Download: MOL2 SDF SMILES Flexibase

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) 1.29 8.64 -41.67 1 6 1 47 318.445 5 ↓
Mid Mid (pH 6-8) 1.29 6.46 -15.91 0 6 0 46 317.437 5 ↓
Mid Mid (pH 6-8) 1.29 8.71 -39.4 1 6 1 47 318.445 5 ↓
Lo Low (pH 4.5-6) 1.29 9.1 -75.65 2 6 2 48 319.453 5 ↓

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Rings

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

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