In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 31 | Yes |
Popular Name: 3-(dibenzylamino)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)propanamide 3-(dibenzylamino)-N-(5-phenyl-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) | 4.85 | 13.6 | -49.46 | 2 | 5 | 1 | 59 | 429.569 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.85 | 11.53 | -15.04 | 1 | 5 | 0 | 58 | 428.561 | 9 | ↓ |
Mid Mid (pH 6-8) | 5.03 | 12.61 | -52.61 | 1 | 5 | 0 | 66 | 428.561 | 9 | ↓ |