UCSF

ZINC65314372

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 10th, 2011 29 Yes

Popular Name: 2-[methyl-[3-methyl-1-(m-tolyl)pyrazolo[3,4-d]thiazol-5-yl]amino]-N-(2-pyridylmethyl)acetamide 2-[methyl-[3-methyl-1-(m-tolyl)p…

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Download: MOL2 SDF SMILES Flexibase

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) 3.11 10.04 -20.27 1 7 0 76 406.515 6 ↓
Lo Low (pH 4.5-6) 3.11 10.45 -52.2 2 7 1 77 407.523 6 ↓

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

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