In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 27 | Yes |
Popular Name: 6-[4-[(4-chlorophenyl)methyl]phenyl]pteridine-2,4,7-triamine 6-[4-[(4-chlorophenyl)methyl]phe…
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) | 3.46 | -6.62 | -13.64 | 6 | 7 | 0 | 129 | 377.839 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.46 | -6.39 | -36.74 | 7 | 7 | 1 | 130 | 378.847 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4874763 | IBM Patent Data |