UCSF

ZINC67965280

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 28 Yes

Popular Name: 2-furyl-[4-[(1-isopropylpyrrol-3-yl)methyl]-1-methyl-1,4,9-triazaspiro[5.5]undecan-9-yl]methanone 2-furyl-[4-[(1-isopropylpyrrol-3…

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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) 2.06 9.87 -42.42 1 6 1 46 385.532 4 ↓
Mid Mid (pH 6-8) 2.06 7.99 -9.38 0 6 0 45 384.524 4 ↓
Mid Mid (pH 6-8) 2.06 9.85 -39.68 1 6 1 46 385.532 4 ↓

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

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