In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-3-(4-tert-butylpiperazin-1-yl)-2-methyl-propan-1-amine (2S)-3-(4-tert-butylpiperazin-1-…
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) | 0.97 | 3.43 | -84.38 | 4 | 3 | 2 | 35 | 215.385 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 1.3 | -41.95 | 3 | 3 | 1 | 34 | 214.377 | 4 | ↓ |