UCSF

ZINC31351672

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2009 32 No

Popular Name: Sodium 4-[[3-(acetylamino)phenyl]amino]-1-amino-9,10-dihydro-9,10-dioxoanthracene-2-sulphonate Sodium 4-[[3-(acetylamino)phenyl…

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CAS Number: [70571-81-2]

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) 1.16 3.43 -56.24 4 9 -1 158 450.452 4 ↓

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