UCSF

ZINC34954712

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 33 No

Popular Name: (4E,5S)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-[(2,5-dimethylphenyl)-hydroxy-methylene]-5-(3-pyridyl)p (4E,5S)-1-(6-chloro-1,3-benzothi…

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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) 4.88 12.24 -56.93 0 6 -1 86 474.949 4 ↓
Lo Low (pH 4.5-6) 4.88 11.35 -13.2 1 6 0 83 475.957 4 ↓

Activity (Go SEA)

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