In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | Yes |
Popular Name: (3S)-1-[2-(cyclopropylamino)acetyl]-3-[(sulfamoylamino)methyl]piperidine (3S)-1-[2-(cyclopropylamino)acet…
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) | -0.87 | -1.21 | -49.11 | 5 | 7 | 1 | 109 | 291.397 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.87 | -1.55 | -65.43 | 4 | 7 | 0 | 111 | 290.389 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.87 | -2.49 | -17.61 | 4 | 7 | 0 | 105 | 290.389 | 6 | ↓ |