UCSF

ZINC66157031

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 20th, 2011 45 No

Popular Name: (2S)-2-[[(2S)-2-[[(2S)-2-amino-4-phenyl-butanoyl]amino]-4-phenyl-butanoyl]amino]-4-phenyl-N-(p-tolyl (2S)-2-[[(2S)-2-[[(2S)-2-amino-4…

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Download: MOL2 SDF SMILES Flexibase

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) 5.28 14.02 -12.3 5 7 0 113 604.795 16 ↓
Mid Mid (pH 6-8) 5.28 14.36 -56.25 6 7 1 115 605.803 16 ↓

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

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