In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2005 | 25 | Yes |
Adenosine, N-(2-hydroxycyclopentyl)-, (1S-trans)- [CAS]; CPD000469631; SAM001247106
CPD000469631; Adenosine, N-(2-hydroxycyclopentyl)-, (1S-trans)- [CAS]
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) | -0.23 | -13.62 | -15.68 | 5 | 10 | 0 | 145 | 351.363 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_SUBSTANCE_COMMENT | NCC_SAMPLE_SUPPLIER : Tocris Cookson Ltd.; NCC_SUPPLIER_STRUCTURE_ID : 1957; 1 water; 1 hydrogen chloride | NIH Clinical Collection via PubChem |
PUBCHEM_SUBSTANCE_COMMENT | SAMPLE_SUPPLIER: Tocris Bioscience; SUPPLIER_STRUCTURE_ID: 1957; SALT: 1 water; 1 hydrogen chloride | NIH Clinical Collection via PubChem |