In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 19 | Yes |
Popular Name: 2-(ethylamino)-1-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]ethanone 2-(ethylamino)-1-[4-(2-thienylme…
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) | 0.93 | 7.73 | -96.9 | 3 | 4 | 2 | 41 | 283.441 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 5.84 | -42.32 | 2 | 4 | 1 | 40 | 282.433 | 5 | ↓ |