In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 15 | Yes |
Popular Name: (2S)-1-(cyclopropylamino)-3-(4-methyl-1-piperidyl)propan-2-ol (2S)-1-(cyclopropylamino)-3-(4-m…
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) | 1.00 | 4.41 | -99.73 | 4 | 3 | 2 | 41 | 214.353 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.00 | 4.95 | -38.88 | 3 | 3 | 1 | 44 | 213.345 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.00 | 3.06 | -34.42 | 3 | 3 | 1 | 37 | 213.345 | 5 | ↓ |