In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: (1S)-N-(cyclopropylmethyl)-N-propyl-1-(3-thienyl)ethane-1,2-diamine (1S)-N-(cyclopropylmethyl)-N-pro…
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) | 2.07 | 4.77 | -43.96 | 3 | 2 | 1 | 31 | 239.408 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.07 | 6.47 | -124.7 | 4 | 2 | 2 | 32 | 240.416 | 7 | ↓ |