Summary
| Name: | PROFLAVINE |
| Formula: | C13 H12 N3 |
| Formal charge: | 1 |
| Formula weight: | 210.254 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3,6-diaminoacridinium |
| OpenEye OEToolkits | 1.5.0 | acridin-10-ium-3,6-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | c3(ccc2cc1ccc(N)cc1[nH+]c2c3)N |
| InChI | InChI | 1.02b | InChI=1/C13H11N3/c14-10-3-1-8-5-9-2-4-11(15)7-13(9)16-12(8)6-10/h1-7H,14-15H2/p+1/fC13H12N3/h16H/q+1 |
| InChIKey | InChI | 1.02b | WDVSHHCDHLJJJR-LJXQPQFLCS |
| SMILES_CANONICAL | CACTVS | 3.341 | Nc1ccc2cc3ccc(N)cc3[nH+]c2c1 |
| SMILES | CACTVS | 3.341 | Nc1ccc2cc3ccc(N)cc3[nH+]c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(cc2c1cc3ccc(cc3[nH+]2)N)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(cc2c1cc3ccc(cc3[nH+]2)N)N |
