UCSF

ZINC33716743

Substance Information

In ZINC since Heavy atoms Benign functionality
July 16th, 2009 35 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) 6.12 13.02 -64.31 0 10 -1 143 492.489 7
Lo Low (pH 4.5-6) 1.89 13.74 -63.7 1 10 0 141 493.497 8

Activity (Go SEA)

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