UCSF

ZINC04592487

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2005 27 No

Popular Name: 6-amino-4-(4-hydroxy-3-methoxyphenyl)-3-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile 6-amino-4-(4-hydroxy-3-methoxyph…

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Other Names:

MFCD01971676

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) 2.23 2.23 -11.84 4 7 0 117 360.373 3 ↓
Mid Mid (pH 6-8) 2.23 1.6 -11 4 7 0 117 360.373 3 ↓
Lo Low (pH 4.5-6) 2.23 2.52 -63.38 5 7 1 119 361.381 3 ↓

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