UCSF

ZINC58541878

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2011 32 No

Popular Name: (2S)-2-amino-N-[(3S)-1-[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl]-2,6-dioxo-3-piperidyl]-3-phenyl-p (2S)-2-amino-N-[(3S)-1-[2-(3-chl…

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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) 1.09 5.47 -20.63 4 8 0 122 460.893 7 ↓
Mid Mid (pH 6-8) 1.09 5.76 -56.79 5 8 1 123 461.901 7 ↓

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

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