UCSF

ZINC34627556

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 1st, 2009 27 Yes

Popular Name: 2-methyl-N-[(6S)-6-[4-(2-pyridyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]propanamid 2-methyl-N-[(6S)-6-[4-(2-pyridyl…

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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) 2.97 8.35 -41.27 2 6 1 63 386.545 4 ↓
Mid Mid (pH 6-8) 2.97 8.04 -15.06 1 6 0 61 385.537 4 ↓
Lo Low (pH 4.5-6) 2.97 10.74 -111.07 3 6 2 64 387.553 4 ↓
Lo Low (pH 4.5-6) 2.97 10.41 -54.5 2 6 1 63 386.545 4 ↓

Activity (Go SEA)

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