UCSF

ZINC62156643

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 26th, 2011 28 Yes

Popular Name: 3-tert-butyl-N-[[4-(diethylaminomethyl)thiazol-2-yl]methyl]imidazo[1,5-a]pyridine-1-carboxamide 3-tert-butyl-N-[[4-(diethylamino…

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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) 3.20 9.81 -39.13 2 6 1 64 400.572 8 ↓
Hi High (pH 8-9.5) 3.20 7.62 -13.28 1 6 0 63 399.564 8 ↓
Lo Low (pH 4.5-6) 3.20 10.22 -75.5 3 6 2 65 401.58 8 ↓

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

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