In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 26th, 2008 | 23 | Yes |
Popular Name: (2S)-N-(1-adamantyl)-2-[(3S,5R)-3,5-dimethyl-1-piperidyl]propanamide (2S)-N-(1-adamantyl)-2-[(3S,5R)-…
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) | 4.33 | 9.78 | -32.98 | 2 | 3 | 1 | 34 | 319.513 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.33 | 7.59 | -6.26 | 1 | 3 | 0 | 32 | 318.505 | 3 | ↓ |