In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 17 | Yes |
Popular Name: (4S)-N1,N1-diethyl-N4-(thiadiazol-4-ylmethyl)pentane-1,4-diamine (4S)-N1,N1-diethyl-N4-(thiadiazo…
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) | 1.98 | 6.25 | -97.67 | 3 | 4 | 2 | 47 | 258.435 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.98 | 5.05 | -33.41 | 2 | 4 | 1 | 42 | 257.427 | 9 | ↓ |