UCSF

ZINC05044921

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 17th, 2006 23 No

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

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Other Names:

MFCD01416756

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) 1.47 0.69 -10.39 3 7 0 106 312.329 4 ↓
Ref Reference (pH 7) 1.47 0.1 -9.94 3 7 0 106 312.329 4 ↓
Lo Low (pH 4.5-6) 1.47 0.52 -48.33 4 7 1 108 313.337 4 ↓

Activity (Go SEA)

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