In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (2S)-2-amino-N-(2-dimethylaminoethyl)-N-(1-methyl-4-piperidyl)butanediamide (2S)-2-amino-N-(2-dimethylaminoe…
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) | -0.80 | 2 | -170.34 | 7 | 7 | 3 | 100 | 302.443 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.80 | 1.67 | -95.28 | 6 | 7 | 2 | 98 | 301.435 | 7 | ↓ |