UCSF

ZINC67974781

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 26 Yes

Popular Name: [5-(imidazol-1-ylmethyl)-2-furyl]-(10-methyl-3,10-diazaspiro[5.6]dodecan-3-yl)methanone [5-(imidazol-1-ylmethyl)-2-furyl…

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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) 1.70 11.47 -91.95 2 6 2 57 358.486 3 ↓
Mid Mid (pH 6-8) 1.70 10.96 -49.29 1 6 1 56 357.478 3 ↓

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

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