UCSF

ZINC59684364

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2011 22 No

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Annotations

Vendors

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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) 5.70 11.35 -45.57 1 4 -1 69 312.474 16
Lo Low (pH 4.5-6) 5.70 9.38 -10.2 2 4 0 66 313.482 16

Activity (Go SEA)

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