UCSF

ZINC36215881

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 25 Yes

Popular Name: (E)-1-[(3S,5R)-4-[3-(dimethylamino)propyl]-3,5-dimethyl-piperazin-1-yl]-3-phenyl-but-2-en-1-one (E)-1-[(3S,5R)-4-[3-(dimethylami…

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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) 2.75 9.83 -40.18 1 4 1 28 344.523 6 ↓
Mid Mid (pH 6-8) 2.75 9.41 -38.95 1 4 1 28 344.523 6 ↓

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

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