UCSF

ZINC01286430

Substance Information

In ZINC since Heavy atoms Benign functionality
August 15th, 2004 23 No

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Annotations

None

Vendors

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) 4.03 9.86 -12.9 1 5 0 63 344.827 5
Hi High (pH 8-9.5) 4.03 10.63 -46.01 0 5 -1 66 343.819 5

Activity (Go SEA)

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