UCSF

ZINC69701703

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 30 Yes

Popular Name: 3-(4-fluorophenyl)-N-[[4-[(1S)-1-hydroxyethyl]phenyl]methyl]-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]aze 3-(4-fluorophenyl)-N-[[4-[(1S)-1…

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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) 4.00 8.68 -11.35 2 5 0 67 407.489 5 ↓
Lo Low (pH 4.5-6) 4.00 9.25 -32.36 3 5 1 68 408.497 5 ↓

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

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