In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 16 | Yes |
Popular Name: 4-amino-N-[[(1S)-cyclohex-3-en-1-yl]methyl]-1H-pyrrole-2-carboxamide 4-amino-N-[[(1S)-cyclohex-3-en-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) | 1.50 | 2.56 | -9.45 | 4 | 4 | 0 | 71 | 219.288 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.06 | 0.72 | -50.52 | 4 | 4 | 1 | 69 | 220.296 | 3 | ↓ |