UCSF

ZINC67559740

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2011 27 Yes

Popular Name: 1-[(5S)-3-[(2-aminopyrimidin-5-yl)methyl]-3,7-diazaspiro[4.5]decan-7-yl]-3-cyclopentyl-propan-1-one 1-[(5S)-3-[(2-aminopyrimidin-5-y…

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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) 1.72 10.84 -48.04 3 6 1 77 372.537 5 ↓
Hi High (pH 8-9.5) 1.72 8.38 -13.16 2 6 0 75 371.529 5 ↓

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

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