UCSF

ZINC32502309

Substance Information

In ZINC since Heavy atoms Benign functionality
May 1st, 2009 32 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) 4.18 13.69 -119.02 2 6 2 61 436.552 3
Hi High (pH 8-9.5) 4.18 11.75 -46.4 1 6 1 60 435.544 3
Hi High (pH 8-9.5) 4.18 11.26 -43.63 1 6 1 60 435.544 3

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