UCSF

ZINC63934761

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 29 No

Popular Name: (4aR,5R)-5-[2-(difluoromethoxy)phenyl]-8,8-dimethyl-5,7,9,10-tetrahydro-4aH-pyrimido[4,5-b]quinoline (4aR,5R)-5-[2-(difluoromethoxy)p…

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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) 2.54 4.1 -19.38 2 7 0 97 403.385 3 ↓
Hi High (pH 8-9.5) 3.08 2.91 -39.03 1 7 -1 103 402.377 3 ↓

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

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