UCSF

ZINC36123902

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 24 Yes

Popular Name: [(3S,5S)-4-(2-methoxyethyl)-3,5-dimethyl-piperazin-1-yl]-(1-methylsulfonyl-4-piperidyl)methanone [(3S,5S)-4-(2-methoxyethyl)-3,5-…

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Vendors

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) 0.38 1.83 -19.98 0 7 0 70 361.508 5 ↓
Mid Mid (pH 6-8) 0.38 4.03 -52.58 1 7 1 71 362.516 5 ↓

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

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