UCSF

ZINC36214209

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 28 Yes

Popular Name: (E)-3-(4-methoxyphenyl)-N-[(1S)-3-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]but-2-enamide (E)-3-(4-methoxyphenyl)-N-[(1S)-…

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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) 2.59 6.45 -7.5 1 6 0 62 387.524 7 ↓
Mid Mid (pH 6-8) 2.59 9.16 -47 2 6 1 63 388.532 7 ↓

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

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