UCSF

ZINC61307101

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 8th, 2011 27 Yes

Popular Name: 1-[1-[(1S)-1-methyl-2-[[(1R)-1-methylbutyl]amino]-2-oxo-ethyl]piperidine-4-carbonyl]piperidine-4-car 1-[1-[(1S)-1-methyl-2-[[(1R)-1-m…

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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) 1.18 5.52 -49.76 4 7 1 97 381.541 7 ↓
Mid Mid (pH 6-8) 1.18 3.36 -21 3 7 0 96 380.533 7 ↓

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

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