UCSF

ZINC34840548

Substance Information

In ZINC since Heavy atoms Benign functionality
September 29th, 2009 35 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) -5.16 -4.98 -111.82 14 15 1 284 503.581 17
Mid Mid (pH 6-8) -5.16 -5.81 -74.25 13 15 0 283 502.573 17

Activity (Go SEA)

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