UCSF

ZINC69705382

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 29th, 2011 19 No

Popular Name: 3-(cyclopentylsulfanylmethyl)-2H-benzo[e][1,2,4]thiadiazine 3-(cyclopentylsulfanylmethyl)-2H…

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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) 2.74 5.88 -22.81 1 4 0 59 296.417 3 ↓
Mid Mid (pH 6-8) 2.74 5.47 -41.21 0 4 -1 61 295.409 3 ↓

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

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