UCSF

ZINC64539210

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2011 36 No

Popular Name: N-[(1'R,5'S,6'S,8'R)-6',8'-bis(4-chlorophenyl)-4-propanoyl-spiro[1,3,4-thiadiazole-5,9'-7-azabicyclo N-[(1'R,5'S,6'S,8'R)-6',8'-bis(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) 6.66 13 -10.83 2 6 0 74 545.536 5 ↓
Lo Low (pH 4.5-6) 6.66 13.54 -33.91 3 6 0 78 546.544 5 ↓

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

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