UCSF

ZINC23331938

Substance Information

In ZINC since Heavy atoms Benign functionality
December 29th, 2008 30 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) 4.80 8.93 -11.44 3 6 0 86 463.335 5
Hi High (pH 8-9.5) 5.26 7.04 -43.38 2 6 -1 89 462.327 5

Activity (Go SEA)

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