UCSF

ZINC32130107

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2009 19 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) 1.82 3.17 -10.91 2 5 0 73 284.381 4
Lo Low (pH 4.5-6) 1.82 2.78 -52.85 3 5 1 74 285.389 4

Activity (Go SEA)

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