UCSF

ZINC66123114

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 43 No

Popular Name: (4S)-4-benzyl-3-(cycloheptylmethyl)-1-[(1S)-1-[[(2S)-2-[[(5S)-5-isobutyl-2-thioxo-imidazolidin-1-yl] (4S)-4-benzyl-3-(cycloheptylmeth…

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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) 8.70 22.47 -36.87 2 5 1 26 627.045 13 ↓
Hi High (pH 8-9.5) 8.70 20.9 -12.95 1 5 0 25 626.037 13 ↓

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

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