UCSF

ZINC05130225

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2006 28 No

Popular Name: 6-amino-4-{2-[(1-methylethyl)oxy]phenyl}-3-phenyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile 6-amino-4-{2-[(1-methylethyl)oxy…

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Other Names:

MFCD02950752

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) 3.64 5.28 -8.61 3 6 0 97 372.428 4 ↓
Lo Low (pH 4.5-6) 3.64 6.2 -54.09 4 6 1 99 373.436 4 ↓

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