In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 17 | Yes |
Popular Name: 3-(3-aminoprop-1-ynyl)-N-[(1R,2S)-2-methylcyclopropyl]benzamide 3-(3-aminoprop-1-ynyl)-N-[(1R,2S…
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) | 1.09 | 4.84 | -50.11 | 4 | 3 | 1 | 57 | 229.303 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.09 | 4.43 | -11.23 | 3 | 3 | 0 | 55 | 228.295 | 2 | ↓ |