| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2010 | 12 | No |
Popular Name: 3-Nitro-1H-pyrrolo[3,2-c]pyridine 3-Nitro-1H-pyrrolo[3,2-c]pyridine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 23612-35-3 , 67058-77-9 , [67066-09-5]
| 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) | 0.95 | 3.99 | -46.02 | 2 | 5 | 1 | 76 | 164.144 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.95 | 3.05 | -28.74 | 0 | 5 | -1 | 73 | 162.128 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.95 | 3.58 | -24.56 | 1 | 5 | 0 | 75 | 163.136 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.