In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 21 | Yes |
Popular Name: [(3R,5S)-3,5-dimethyl-1-adamantyl]-(4-methylpiperazin-1-yl)methanone [(3R,5S)-3,5-dimethyl-1-adamanty…
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) | 2.62 | 6.56 | -7.18 | 0 | 3 | 0 | 24 | 290.451 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 8.92 | -46.87 | 1 | 3 | 1 | 25 | 291.459 | 1 | ↓ |