UCSF

ZINC34627555

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Substance Information

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

Popular Name: 2-methyl-N-[(6R)-6-[4-(2-pyridyl)piperazin-1-yl]-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]propanamid 2-methyl-N-[(6R)-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 8.4 -41.13 2 6 1 63 386.545 4 ↓
Mid Mid (pH 6-8) 2.97 8.09 -15.04 1 6 0 61 385.537 4 ↓
Lo Low (pH 4.5-6) 2.97 10.73 -111.25 3 6 2 64 387.553 4 ↓
Lo Low (pH 4.5-6) 2.97 10.39 -54.99 2 6 1 63 386.545 4 ↓

Activity (Go SEA)

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