UCSF

ZINC03984241

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2005 29 Yes

Popular Name: Cn1c2c(c(=O)n(c1=O)C)n3cc(n(c3n2)CCCOC)c4ccc(cc4)OC Cn1c2c(c(=O)n(c1=O)C)n3cc(n(c3n2…

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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) 2.41 11.14 -13.78 0 9 0 85 397.435 6 ↓
Mid Mid (pH 6-8) 2.41 11.61 -38.55 1 9 1 86 398.443 6 ↓

Activity (Go SEA)

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