In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 21 | Yes |
Popular Name: 5-(3-aminoprop-1-ynyl)-N-(o-tolyl)pyridine-3-sulfonamide 5-(3-aminoprop-1-ynyl)-N-(o-toly…
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) | 1.02 | 2.92 | -78.96 | 3 | 5 | 0 | 89 | 301.371 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.02 | 2.51 | -43.44 | 2 | 5 | -1 | 87 | 300.363 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.02 | 2.86 | -56.18 | 4 | 5 | 1 | 87 | 302.379 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.02 | 2.45 | -9.73 | 3 | 5 | 0 | 85 | 301.371 | 3 | ↓ |