UCSF

ZINC16443330

Substance Information

In ZINC since Heavy atoms Benign functionality
August 28th, 2008 29 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) 1.88 5.14 -13.75 1 7 0 81 421.494 6
Lo Low (pH 4.5-6) 1.88 7 -43.46 2 7 1 82 422.502 6

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