UCSF

ZINC67447073

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 27 Yes

Popular Name: [(7S)-2-amino-7-methyl-4-(m-tolyl)-5,7-dihydropyrrolo[3,4-d]pyrimidin-6-yl]-(3-aminophenyl)methanone [(7S)-2-amino-7-methyl-4-(m-toly…

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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) 1.91 7.62 -11.94 4 6 0 98 359.433 2 ↓

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

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