UCSF

ZINC55035875

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 10th, 2010 27 Yes

Popular Name: (5S)-7-[(4-fluorophenyl)methyl]-3-[(2-methoxypyrimidin-5-yl)methyl]-3,7-diazaspiro[4.5]decane (5S)-7-[(4-fluorophenyl)methyl]-…

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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) 2.21 6.08 -47.43 1 5 1 43 371.48 5 ↓
Hi High (pH 8-9.5) 2.21 4.03 -8.46 0 5 0 41 370.472 5 ↓

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

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