In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 22nd, 2006 | 21 | Yes |
Popular Name: 2-amino-3-(indol-3-ylidenemethyl)-7-thia-1,5,9-triazabicyclo[4.3.0]nona-2,5,8-trien-4-one 2-amino-3-(indol-3-ylidenemethyl…
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) | 1.73 | 3.73 | -33.15 | 2 | 6 | 0 | 86 | 295.327 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.73 | 4.13 | -52.99 | 3 | 6 | 1 | 87 | 296.335 | 1 | ↓ |