In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 18 | Yes |
Popular Name: 4-amino-N-[(2S)-2-(1-piperidyl)propyl]-1H-pyrrole-2-carboxamide 4-amino-N-[(2S)-2-(1-piperidyl)p…
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) | 0.96 | 3.09 | -42.75 | 5 | 5 | 1 | 75 | 251.354 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.52 | 1.24 | -93.34 | 5 | 5 | 2 | 74 | 252.362 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.