UCSF

ZINC60018123

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 41 No

Popular Name: (3S)-1-(3-phenylpropylsulfonyl)-N-[4-[[3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]piperidine-3-carbo (3S)-1-(3-phenylpropylsulfonyl)-…

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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) 5.25 9.59 -58.28 1 8 -1 115 608.684 11 ↓
Mid Mid (pH 6-8) 5.25 9.58 -26.21 2 8 0 113 609.692 11 ↓

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

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