In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2010 | 21 | Yes |
Popular Name: (1S)-N-(cyclopropylmethyl)-1-(3-propoxyphenyl)-N-propyl-ethane-1,2-diamine (1S)-N-(cyclopropylmethyl)-1-(3-…
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) | 3.39 | 7.28 | -47.36 | 3 | 3 | 1 | 40 | 291.459 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.39 | 8.46 | -127.2 | 4 | 3 | 2 | 41 | 292.467 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.