UCSF

ZINC08569237

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 1st, 2006 31 No

Popular Name: 6-amino-3-(1,3-benzodioxol-5-yl)-4-(3-ethoxy-4-hydroxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile 6-amino-3-(1,3-benzodioxol-5-yl)…

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Other Names:

MFCD01971843

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) 2.50 1.81 -14.53 4 9 0 136 418.409 4 ↓
Lo Low (pH 4.5-6) 2.50 2.04 -66.85 5 9 1 137 419.417 4 ↓

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