UCSF

ZINC67459687

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 10th, 2011 27 Yes

Popular Name: N,N-diethyl-10-[(2-fluorophenyl)methyl]-7-methyl-3,7,10-triazaspiro[5.5]undecane-3-carboxamide N,N-diethyl-10-[(2-fluorophenyl)…

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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) 2.89 9.34 -40.11 1 5 1 31 377.528 4 ↓
Mid Mid (pH 6-8) 2.89 7.1 -10.2 0 5 0 30 376.52 4 ↓
Mid Mid (pH 6-8) 2.89 8.78 -46.8 1 5 1 31 377.528 4 ↓

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

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