UCSF

ZINC36112943

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 31 Yes

Popular Name: 3-[[4-[(3S,5R)-3,5-dimethylpiperidine-1-carbonyl]phenyl]methylamino]-4-(4-methyl-1-piperidyl)cyclobu 3-[[4-[(3S,5R)-3,5-dimethylpiper…

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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) -0.71 9.27 -36.3 2 6 1 73 424.565 4 ↓
Mid Mid (pH 6-8) -0.08 7.47 -20.09 1 6 0 79 423.557 3 ↓

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

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