In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 28 | Yes |
Popular Name: N-[2-[1-[2-(azepan-1-yl)ethyl]indol-3-yl]ethyl]-3-hydroxy-3-methyl-butanamide N-[2-[1-[2-(azepan-1-yl)ethyl]in…
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) | 3.33 | 10.9 | -49.32 | 3 | 5 | 1 | 59 | 386.56 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.33 | 9.08 | -10.18 | 2 | 5 | 0 | 57 | 385.552 | 8 | ↓ |