UCSF

ZINC67946993

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 25 Yes

Popular Name: 4-chloro-5-[(1,4-dimethyl-1,4,9-triazaspiro[5.5]undecan-9-yl)methyl]-2-pyrrolidin-1-yl-thiazole 4-chloro-5-[(1,4-dimethyl-1,4,9-…

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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) 2.72 6.72 -36.97 1 5 1 27 385.001 3 ↓
Hi High (pH 8-9.5) 2.72 6.88 -36.71 1 5 1 27 385.001 3 ↓
Hi High (pH 8-9.5) 2.72 4.91 -7.01 0 5 0 26 383.993 3 ↓

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

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