UCSF

ZINC67665265

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 12th, 2011 45 No

Popular Name: (3R)-9-methyl-3-[(2-methylimidazol-1-yl)methyl]-6-[[(6S)-9-methyl-6-[(2-methylimidazol-1-yl)methyl]- (3R)-9-methyl-3-[(2-methylimidaz…

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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) 4.71 21.74 -56.95 1 8 1 81 599.759 6 ↓
Hi High (pH 8-9.5) 4.71 21.27 -38.92 0 8 0 80 598.751 6 ↓
Mid Mid (pH 6-8) 1.30 22.08 -77.85 2 8 2 83 600.767 6 ↓

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