UCSF

ZINC67447141

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 26 Yes

Popular Name: 5-methyl-9-(4-phenylthiazole-2-carbonyl)-2,5,9-triazaspiro[5.5]undecan-1-one 5-methyl-9-(4-phenylthiazole-2-c…

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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) 1.17 5.42 -54.35 2 6 1 67 371.486 2 ↓
Mid Mid (pH 6-8) 1.17 3.24 -15.14 1 6 0 66 370.478 2 ↓

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

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