UCSF

ZINC10503641

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2007 31 Yes

Popular Name: [4-[(4-methyl-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraen-8-yl)methoxy]phenyl]-(4-thiazol-2-ylpipera [4-[(4-methyl-6,9-diazabicyclo[4…

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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) 3.20 -2.44 -15.54 0 7 0 63 433.537 5 ↓
Mid Mid (pH 6-8) 3.20 -2.26 -39.69 1 7 1 64 434.545 5 ↓

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

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