UCSF

ZINC04168841

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 30 No

Popular Name: 6-amino-3-(2,5-dimethyl-3-thienyl)-4-(4-hydroxy-3,5-dimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile 6-amino-3-(2,5-dimethyl-3-thieny…

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Other Names:

MFCD03863045

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) 2.28 2.85 -13.53 4 8 0 126 424.482 4 ↓
Ref Reference (pH 7) 2.64 1.98 -15.57 3 8 0 122 424.482 4 ↓
Lo Low (pH 4.5-6) 2.28 3.08 -64.04 5 8 1 128 425.49 4 ↓

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