UCSF

ZINC05562709

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2006 27 No

Popular Name: N-[4-[4-amino-3-cyano-9-(2-thienyl)-5-oxa-7,8-diazabicyclo[4.3.0]nona-3,6,9-trien-2-yl]phenyl]acetam N-[4-[4-amino-3-cyano-9-(2-thien…

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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) 1.90 3.24 -15.28 4 7 0 117 377.429 3 ↓
Lo Low (pH 4.5-6) 1.90 3.47 -63.57 5 7 1 118 378.437 3 ↓

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

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