In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 19 | Yes |
Popular Name: cyclopropyl-[(3S,5R)-4-[3-(dimethylamino)propyl]-3,5-dimethyl-piperazin-1-yl]methanone cyclopropyl-[(3S,5R)-4-[3-(dimet…
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) | 1.39 | 6.27 | -41.69 | 1 | 4 | 1 | 28 | 268.425 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 8.35 | -105.43 | 2 | 4 | 2 | 29 | 269.433 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 5.88 | -40.64 | 1 | 4 | 1 | 28 | 268.425 | 5 | ↓ |