UCSF

ZINC03646722

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 33 Yes

Popular Name: [1-amino-3-[[4-[[4-[(4-amino-1-methyl-pyrrole-2-carbonyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]-1 [1-amino-3-[[4-[[4-[(4-amino-1-m…

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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) -0.80 -6.72 -46.66 9 12 1 179 454.515 8 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0880499A1; US6165980; WO1997028123A1; WO2000006541A1; WO2000006542A1 IBM Patent Data

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