UCSF

ZINC65336461

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 10th, 2011 16 Yes

Popular Name: 6-amino-2-(2-methylanilino)-5H-pyrimidin-4-one 6-amino-2-(2-methylanilino)-5H-p…

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Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.89 4.92 -33.94 3 5 0 84 216.244 2 ↓
Hi High (pH 8-9.5) 0.89 4.45 -47.76 2 5 -1 82 215.236 2 ↓
Lo Low (pH 4.5-6) 0.89 5.53 -49.86 4 5 1 81 217.252 2 ↓

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

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