UCSF

ZINC39301487

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 35 Yes

Popular Name: 3-[[2-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide 3-[[2-amino-6-(3-methoxyanilino)…

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Annotations

Vendors

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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) 3.49 10.24 -20.73 5 10 0 135 475.553 10 ↓
Mid Mid (pH 6-8) 3.49 10.33 -42.65 6 10 1 136 476.561 10 ↓
Mid Mid (pH 6-8) 3.49 10.21 -43.93 6 10 1 136 476.561 10 ↓

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