UCSF

ZINC39500536

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 27th, 2010 26 No

Popular Name: 4-[4-[(6aR)-1-(3-pyridylmethyl)-6aH-pyrazolo[3,4-d]imidazol-5-yl]phenyl]thiadiazole 4-[4-[(6aR)-1-(3-pyridylmethyl)-…

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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) 1.09 5.06 -14.58 0 7 0 79 359.418 4 ↓
Lo Low (pH 4.5-6) 1.09 5.53 -39.28 1 7 1 80 360.426 4 ↓

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

No pre-computed analogs available. Try a structural similarity search.