UCSF

ZINC32205989

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 21 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) 3.23 8.9 -47.02 3 3 1 40 307.483 6
Hi High (pH 8-9.5) 3.23 6.53 -13.22 2 3 0 38 306.475 6

Activity (Go SEA)

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