UCSF

ZINC20120871

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2008 31 Yes

Popular Name: 3-[[[(1S)-1-[1-(1,1-dimethylpropyl)tetrazol-5-yl]propyl]-(3-hydroxypropyl)amino]methyl]-8-methyl-1H- 3-[[[(1S)-1-[1-(1,1-dimethylprop…

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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) 2.57 6.53 -34.38 3 8 1 101 427.573 10 ↓
Hi High (pH 8-9.5) 2.57 3.79 -12.49 2 8 0 100 426.565 10 ↓

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

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