| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2004 | 19 | No |
Popular Name: 4-Nitropyrene 4-Nitropyrene
Find On: PubMed — Wikipedia — Google
CAS Number: 57835-92-4
4-Nitropyrene; 4-Nitropyrene [Nitroarenes]; BRN 1979733; CCRIS 4231; LS-129452; Pyrene, 4-nitro-
| 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) | 4.76 | 1.98 | -10.4 | 0 | 3 | 0 | 45 | 247.253 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 198 | TCI |
