In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2010 | 31 | No |
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) | -0.54 | 2.85 | -59.15 | 4 | 9 | -1 | 161 | 427.433 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.54 | 4.49 | -63.24 | 5 | 9 | 0 | 162 | 428.441 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_SUBSTANCE_COMMENT | NCC_SAMPLE_SUPPLIER : LightBiologicals; NCC_SUPPLIER_STRUCTURE_ID : T-1856; NCC_SUPPLIER_SAMPLE_COMMENTS : YELLOW POWDER | NIH Clinical Collection via PubChem |
PUBCHEM_SUBSTANCE_COMMENT | SAMPLE_SUPPLIER: LightBiologicals; SUPPLIER_STRUCTURE_ID: T-1856; SUPPLIER_COMMENTS: YELLOW POWDER | NIH Clinical Collection via PubChem |