UCSF

ZINC58344370

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2011 23 Yes

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

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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) 2.95 2.99 -27.24 1 6 0 85 345.405 3 ↓
Mid Mid (pH 6-8) 2.95 2.58 -43.58 0 6 -1 87 344.397 3 ↓

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

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